⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL27736000 | 0.98 | ALDH1A1 (0.42) | — | |
| Dimethyl Sulfoxide SCHEMBL28221518 | 0.89 | POLB (0.37) | — | |
| SCHEMBL1086891 | 0.85 | — | — | |
| SCHEMBL28119767 | 0.84 | MMP8 (0.37) | — | |
| SCHEMBL98575 | 0.83 | — | — | |
| SCHEMBL7716309 | 0.81 | HDAC4 (0.41) | — | |
| SCHEMBL16481576 | 0.81 | — | — | |
| SCHEMBL21488385 | 0.81 | POLB (0.44) | — | |
| SCHEMBL27032225 | 0.81 | CYP4F2 (0.41) | — | |
| SCHEMBL543675 | 0.81 | ALDH1A1 (0.41) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Appears in 4354 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-121574075-A | Photoacid generator Synthesis method of intermediate | 苏州源起材料科技有限公司 | 2026-02-27 | — | — | CN | claimed |
| CN-119930486-A | Para-toluenesulfonyl modified difluoro acetonitrile precursor compound, and synthetic method and application thereof | 平顶山学院 | 2025-05-06 | — | — | CN | claimed |
| CN-119661449-A | Preparation method of 5- (difluoromethoxy) pyrazine-2-amine | 无锡捷化医药科技有限公司 | 2025-03-21 | — | — | CN | claimed |
| CN-114920692-B | Fluorine-containing pyridine nitrogen oxide derivative and preparation method thereof | 上海大学 | 2025-03-14 | — | — | CN | claimed |
| CN-119431706-A | Fatigue-resistant polyurethane elastomer and preparation method and application thereof | 万勋科技(深圳)有限公司 | 2025-02-14 | — | — | CN | claimed |
| CN-116041286-B | Preparation method of 3, 3-difluoro-4-hydroxy-5- (hydroxymethyl) dihydrofuran-2 (3H) -ketone | 苏州永健生物医药有限公司 | 2025-01-28 | — | — | CN | claimed |
| CN-113511972-B | (E) Process for preparing (E) -4-aryl-2, 2-difluoro-3-butenoic acid derivatives | 昆明理工大学 | 2025-01-21 | — | — | CN | claimed |
| CN-115838338-B | Method for preparing amide | 浙江工业大学 | 2024-12-24 | — | — | CN | claimed |
| CN-117466799-B | N-substituted phthalic acid diamide preparation method of imine compound | 西北师范大学 | 2024-12-24 | — | — | CN | claimed |
| CN-116465985-B | Method for detecting residual solvent in alpha-ribose mesylate by gas chromatography | 连云港杰瑞药业有限公司 | 2024-12-10 | — | — | CN | claimed |
| CN-101265221-A | Modafinil fluorine-containing analogue and synthesizing method thereof | ZHAOXIONG PAN (CN) | 2008-09-17 | — | — | CN | claimed |
| US-7084281-B2 | Synthesis of dihalohydrins and tri- and tetra-substituted olefins | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2006-08-01 | — | — | US | claimed |
| CN-1239458-C | Process for preparing bromodifluoacetic acid compounds | ATOFINA (FR) | 2006-02-01 | — | — | CN | claimed |
| US-6906219-B2 | Method for preparing bromodifluoroacetic compounds | ATOFINA (FR) | 2005-06-14 | — | — | US | claimed |
| US-20040143125-A1 | Synthesis of dihalohydrins and tri- and tetra-substituted olefins | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2004-07-22 | — | — | US | claimed |
| EP-1341784-A2 | PROCESS FOR MAKING A THROMBIN INHIBITOR | Merck & Co., Inc. (US) | 2003-09-10 | — | — | EP | claimed |
| US-20030032836-A1 | Method for preparing bromodifluoroacetic compounds | ATOFINA (FR) | 2003-02-13 | — | — | US | claimed |
| CN-1392133-A | Process for preparing bromodifluoacetic acid compounds | ATOFINA (FR) | 2003-01-22 | — | — | CN | claimed |
| US-20020103379-A1 | Process for making a thrombin inhibitor | MERCK SHARP & DOHME LTD. (GB) | 2002-08-01 | — | — | US | claimed |
| WO-2002046160-A2 | PROCESS FOR MAKING A THROMBIN INHIBITOR | MERCK & CO., INC. (US) | 2002-06-13 | — | — | WO | claimed |