⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9977650 | 0.77 | — | — | |
| SCHEMBL7110006 | 0.75 | — | — | |
| SCHEMBL6550787 | 0.72 | — | — | |
| SCHEMBL7112428 | 0.71 | — | — | |
| SCHEMBL20125478 | 0.70 | — | — | |
| SCHEMBL7115865 | 0.68 | MEN1 (0.32) | — | |
| SCHEMBL7115165 | 0.67 | MEN1 (0.34) | — | |
| SCHEMBL7113474 | 0.67 | MEN1 (0.34) | — | |
| SCHEMBL6590977 | 0.63 | — | — | |
| SCHEMBL4547000 | 0.61 | NOS3 (0.30) | — |
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
Claimed or disclosed in 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119405064-A | Anti-alcoholic composition containing dendrobium nobile small molecule peptide and preparation method thereof | 黔西南民族职业技术学院 | 2025-02-11 | — | — | CN | claimed |
| CN-108484512-B | Method for synthesizing 2,3, 5-trimethylpyrazine | 滕州市悟通香料有限责任公司 | 2020-05-05 | — | — | CN | claimed |
| CN-108484512-A | A method of synthesis 2,3,5- trimethylpyrazines | 滕州市悟通香料有限责任公司 | 2018-09-04 | — | — | CN | claimed |
| US-12565673-B2 | Methods for the design of nonallosteric sirtuin activating compounds | CHAKRABARTI ADVANCED TECHNOLOGY LLC (US) | 2026-03-03 | — | — | US | disclosed |
| CN-119405064-A | Anti-alcoholic composition containing dendrobium nobile small molecule peptide and preparation method thereof | 黔西南民族职业技术学院 | 2025-02-11 | — | — | CN | disclosed |
| CN-119405064-A | Anti-alcoholic composition containing dendrobium nobile small molecule peptide and preparation method thereof | 黔西南民族职业技术学院 | 2025-02-11 | — | — | CN | disclosed |
| WO-2024096382-A1 | METHOD FOR MANUFACTURING ULTRA-THIN RADIATION SHIELDING PAPER HAVING MORPHO BUTTERFLY WING STRUCTURE | 계명대학교 산학협력단 | 2024-05-10 | — | — | WO | disclosed |
| US-11459597-B2 | Methods for the design of mechanism-based sirtuin activating compounds | CHAKRABARTI ADVANCED TECHNOLOGY LLC (US) | 2022-10-04 | — | — | US | disclosed |
| CN-113328080-B | Double-coated lithium-rich manganese-based positive electrode material and preparation method thereof | 广东工业大学 | 2022-03-22 | — | — | CN | disclosed |
| CN-108484512-B | Method for synthesizing 2,3, 5-trimethylpyrazine | 滕州市悟通香料有限责任公司 | 2020-05-05 | — | — | CN | disclosed |
| CN-108484512-B | Method for synthesizing 2,3, 5-trimethylpyrazine | 滕州市悟通香料有限责任公司 | 2020-05-05 | — | — | CN | disclosed |
| CN-108484512-A | A method of synthesis 2,3,5- trimethylpyrazines | 滕州市悟通香料有限责任公司 | 2018-09-04 | — | — | CN | disclosed |
| US-20100204438-A1 | METHOD FOR PRODUCING TEDA DERIVATIVES | BASF SE (DE) | 2010-08-12 | — | — | US | disclosed |
| EP-2197882-A2 | METHOD FOR PRODUCING TEDA DERIVATIVES | Basf Se (DE) | 2010-06-23 | — | — | EP | disclosed |
| WO-2009030649-A2 | METHOD FOR PRODUCING TEDA DERIVATIVES | BASF SE (DE) | 2009-03-12 | — | — | WO | disclosed |
| EP-1357193-A1 | Preparation of pyrazines | SOCIETE DES PRODUITS NESTLE S.A. (CH) | 2003-10-29 | — | — | EP | disclosed |