⚠ 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 | |
|---|---|---|---|---|
| Charcoal, Activated SCHEMBL8625952 | 1.00 | — | — | |
| Charcoal, Activated SCHEMBL2976 | 1.00 | — | — | |
| Charcoal, Activated SCHEMBL4624102 | 1.00 | — | — | |
| Charcoal, Activated SCHEMBL30392268 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL7639441 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL29595599 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL10977702 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL9770557 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL30674022 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL30554495 | 0.82 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101475603-A | Method for selectively synthesizing single chiral or double chiral ferrocenyl amine | UNIV ZHENGZHOU (CN) | 2009-07-08 | — | — | CN | claimed |
| CN-114280034-A | Application of oxygen bomb combustion method in determination of waste palladium-carbon-palladium content and determination method | 浙江微通催化新材料有限公司 | 2022-04-05 | — | — | CN | disclosed |
| CN-106588673-B | A kind of preparation method of 2- methyl -5- 5 amido benzotrifluorides | 金凯(辽宁)化工有限公司 | 2018-06-26 | — | — | CN | disclosed |
| CN-106588673-A | Preparation method of 2-methyl-5-aminotrifluorotoluene | 金凯(辽宁)化工有限公司 | 2017-04-26 | — | — | CN | disclosed |
| CN-101475603-A | Method for selectively synthesizing single chiral or double chiral ferrocenyl amine | UNIV ZHENGZHOU (CN) | 2009-07-08 | — | — | CN | disclosed |
| WO-1998024789-A1 | PROCESS FOR MAKING η-METHYLENE-10-DEAZAAMINOPTERIN (MDAM) | BIONUMERIK PHARMACEUTICALS, INC. (US) | 1998-06-11 | — | — | WO | disclosed |
| EP-0450066-B1 | CARBOSTYRIL DERIVATIVES | OTSUKA PHARMA CO LTD (JP) | 1996-09-11 | — | — | EP | disclosed |
| US-5401740-A | FOR INHIBITING PLATELET AGGREGATION | OTSUKA PHARMACEUTICAL CO. (JP) | 1995-03-28 | — | — | US | disclosed |
| US-5227381-A | Anticoagulant | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1993-07-13 | — | — | US | disclosed |
| EP-0450066-A1 | CARBOSTYRIL DERIVATIVES | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1991-10-09 | — | — | EP | disclosed |