mlsanityData to 14 Oct 2026

How Transformers Learn to Plan via Multi-Token Prediction

arXiv 2604.11912 ↗First posted 13 Apr 2026cs.LG cs.AIcited by 0

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Abstract (arXiv)

While next-token prediction (NTP) has been the standard objective for training language models, it often struggles to capture global structure in reasoning tasks. Multi-token prediction (MTP) has recently emerged as a promising alternative, yet its underlying mechanisms remain poorly understood. In this paper, we study how MTP facilitates reasoning, with a focus on planning. Empirically, we show that MTP consistently outperforms NTP on both synthetic graph path-finding tasks and more realistic reasoning benchmarks, such as Countdown and boolean satisfiability problems. Theoretically, we analyze a simplified two-layer Transformer on a star graph task. We prove that MTP induces a two-stage reverse reasoning process: the model first attends to the end node and then reconstructs the path by tracing intermediate nodes backward. This behavior arises from a gradient decoupling property of MTP, which provides a cleaner training signal compared to NTP. Ultimately, our results highlight how multi-token objectives inherently bias optimization toward robust and interpretable reasoning circuits.

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32 of 41 references.

References · 32

  1. 2020Scaling Laws for Neural Language Modelscited by 6,586
  2. 2023Tree of Thoughts: Deliberate Problem Solving with Large Language Modelscited by 3,211
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  4. 2024Better & Faster Large Language Models via Multi-token Predictioncited by 360
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  12. 2024Beyond Autoregression: Discrete Diffusion for Complex Reasoning and Planningcited by 135
20 more
  1. 2024How Transformers Learn Causal Structure with Gradient Descentcited by 118
  2. 2025A Survey of Frontiers in LLM Reasoning: Inference Scaling, Learning to Reason, and Agentic Systemscited by 111
  3. 2024Can Looped Transformers Learn to Implement Multi-step Gradient Descent for In-context Learning?cited by 65
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  13. 2025Metastable Dynamics of Chain-of-Thought Reasoning: Provable Benefits of Search, RL and Distillationcited by 25
  14. 2024Unveil Benign Overfitting for Transformer in Vision: Training Dynamics, Convergence, and Generalizationcited by 17
  15. 2025Multi-Token Prediction Needs Registerscited by 16
  16. 2025L-MTP: Leap Multi-Token Prediction Beyond Adjacent Context for Large Language Modelscited by 15
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  19. 2025Efficient Joint Prediction of Multiple Future Tokenscited by 10
  20. 2025Understanding and Enhancing the Planning Capability of Language Models via Multi-Token Predictioncited by 6

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  1. 2025Multi-head Transformers Provably Learn Symbolic Multi-step Reasoning via Gradient Descent
  2. 2025From Next Token Prediction to (STRIPS) World Models
  3. 2025On the Bias of Next-Token Predictors Toward Systematically Inefficient Reasoning: A Shortest-Path Case Study
  4. 2026Beyond Token-Level Policy Gradients for Complex Reasoning with Large Language Models
  5. 2026LoopMTP: A looped transformer guided by latent multi-token prediction
  6. 2026T^2MLR: Transformer with Temporal Middle-Layer Recurrence
  7. 2026On the Token Value Inequality in Efficient Reasoning
  8. 2026LogicGraph : Benchmarking Multi-Path Logical Reasoning via Neuro-Symbolic Generation and Verification