⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3730209 | 0.97 | CES1 (0.50) | — | |
| SCHEMBL9385485 | 0.97 | CES1 (0.50) | — | |
| SCHEMBL1022555 | 0.92 | KMT2A (0.62) | — | |
| Ethylene Glycol SCHEMBL28684007 | 0.92 | CES1 (0.55) | — | |
| SCHEMBL25405661 | 0.90 | KMT2A (0.67) | — | |
| SCHEMBL5708418 | 0.90 | KMT2A (0.67) | — | |
| SCHEMBL29019016 | 0.90 | KMT2A (0.67) | — | |
| SCHEMBL29018329 | 0.90 | KMT2A (0.67) | — | |
| SCHEMBL1278378 | 0.90 | KMT2A (0.67) | — | |
| SCHEMBL25403115 | 0.90 | KMT2A (0.67) | — |
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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8461135-B2 | Boron-containing small molecules as anti-inflammatory agents | ANACOR PHARMACEUTICALS, INC. (US) | 2013-06-11 | — | — | US | claimed |
| US-8039450-B2 | Boron-containing small molecules as anti-inflammatory agents | ANACOR PHARMACEUTICALS, INC. (US) | 2011-10-18 | — | — | US | claimed |
| CN-118667775-A | Biocatalyst and method for synthesizing chiral alcohol compound | 宁波酶赛生物工程有限公司 | 2024-09-20 | — | — | CN | disclosed |
| WO-2024188081-A1 | BIOCATALYST AND METHOD FOR SYNTHESIZING CHIRAL ALCOHOL COMPOUNDS | ENZYMASTER (NINGBO) BIO-ENGINEERING CO., LTD. (CN) | 2024-09-19 | — | — | WO | disclosed |
| US-11718758-B2 | Aqueous dispersion of colored particles | MITSUBISHI PENCIL COMPANY, LIMITED (JP) | 2023-08-08 | — | — | US | disclosed |
| EP-3725854-B1 | COLORED PARTICLE AQUEOUS DISPERSION | MITSUBISHI PENCIL CO (JP) | 2023-07-05 | — | — | EP | disclosed |
| CN-111004679-B | Lysimachia capillipes extract and essence | 福建中烟工业有限责任公司 | 2023-04-07 | — | — | CN | disclosed |
| CN-111004679-A | Lysimachia capillipes extract and essence | 福建中烟工业有限责任公司 | 2020-04-14 | — | — | CN | disclosed |
| CN-110498781-A | A kind of synthetic method of D, L- pantolactone | SHANGHAI DODGEN CHEMICAL TECH CO LTD | 2019-11-26 | — | — | CN | disclosed |
| CN-107118085-A | A kind of synthetic method of 3,4 heptadione | 天津市安凯特科技发展有限公司 | 2017-09-01 | — | — | CN | disclosed |
| EP-2316926-B1 | Enantioselective production of alpha-hydroxy carbonyl compounds | UNIV BONN (DE) | 2016-04-13 | — | — | EP | disclosed |
| JP-2000053607-A | HYDROXY-METHYL-HEXANONE | GIVAUDAN ROURE INTERNATL SA | 2000-02-22 | — | — | JP | disclosed |
| CN-1235150-A | Hydroxy-methyl-hexanones | GIVAUDAN ROURE INT (CH) | 1999-11-17 | — | — | CN | disclosed |
| CN-1235150-A | Hydroxy-methyl-hexanones | GIVAUDAN ROURE INT (CH) | 1999-11-17 | — | — | CN | disclosed |
| EP-0952140-A1 | Hydroxy-methyl-hexanones | Givaudan Roure (International) S.A. (CH) | 1999-10-27 | — | — | EP | disclosed |
| EP-0952140-A1 | Hydroxy-methyl-hexanones | Givaudan Roure (International) S.A. (CH) | 1999-10-27 | — | — | EP | disclosed |
| EP-0882715-A1 | NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1998-12-09 | — | — | EP | disclosed |
| EP-0835248-A1 | 1-AMINO-3-BENZYLURACILS | BASF AKTIENGESELLSCHAFT (DE) | 1998-04-15 | — | — | EP | disclosed |
| WO-1997001543-A1 | 1-AMINO-3-BENZYLURACILS | BASF AKTIENGESELLSCHAFT (DE) | 1997-01-16 | — | — | WO | disclosed |
| EP-0159684-A2 | (6,11-Dihydro-11-oxodibenz(b,e)oxepinyl)pentanoic acids and derivatives, a process and intermediates for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1985-10-30 | — | — | EP | disclosed |