⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28301948 | 0.86 | EPHX1 (0.50) | — | |
| SCHEMBL6021857 | 0.84 | EPHX1 (0.56) | — | |
| SCHEMBL377344 | 0.81 | MMP1 (0.40) | — | |
| SCHEMBL6858080 | 0.81 | MMP1 (0.52) | — | |
| SCHEMBL149370 | 0.80 | — | — | |
| SCHEMBL583601 | 0.79 | — | — | |
| SCHEMBL5462094 | 0.79 | — | — | |
| SCHEMBL24359054 | 0.78 | — | — | |
| SCHEMBL1104669 | 0.78 | — | — | |
| SCHEMBL2560023 | 0.78 | MMP1 (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
Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4267202-A | Method for modifying the surface properties of polymer substrates | KANSAI PAINT CO., LTD. (JP) | 1981-05-12 | — | — | US | claimed |
| EP-1078636-B1 | PHARMACEUTICAL COMPOSITION FOR USE IN EMERGENCY TREATMENT AND PREPARATION METHOD THEREOF | ZHAO CHAOYING (CN) | 2010-02-03 | — | — | EP | disclosed |
| US-7309502-B2 | Pharmaceutical compositions for treating and saving and the method for the preparation thereof | ZHAO CHAOYING | 2007-12-18 | — | — | US | disclosed |
| US-6986905-B1 | Pharmaceutical compositions for treating and saving and the method for the preparation thereof | ZHAO CHAOYING | 2006-01-17 | — | — | US | disclosed |
| US-20050288235-A1 | Novel pharmaceutical compositions for treating and saving and the method for the preparation thereof | ZHAO CHAOYING | 2005-12-29 | — | — | US | disclosed |
| EP-1078636-A1 | NOVEL PHARMACEUTICAL COMPOSITION FOR USE IN EMERGENCY TREATMENT AND PREPARATION METHOD THEREOF | Zhao, Chaoying (CN) | 2001-02-28 | — | — | EP | disclosed |
| US-4267202-A | Method for modifying the surface properties of polymer substrates | KANSAI PAINT CO., LTD. (JP) | 1981-05-12 | — | — | US | disclosed |