⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1306044 | 0.82 | ALDH1A1 (0.38) | — | |
| SCHEMBL4342934 | 0.75 | ALDH1A1 (0.41) | — | |
| SCHEMBL12826228 | 0.72 | ALDH1A1 (0.33) | — | |
| SCHEMBL16984017 | 0.71 | — | — | |
| SCHEMBL8610971 | 0.70 | — | — | |
| SCHEMBL21101578 | 0.69 | ALDH1A1 (0.36) | — | |
| SCHEMBL18087309 | 0.69 | — | — | |
| SCHEMBL1305023 | 0.69 | — | — | |
| SCHEMBL1305024 | 0.69 | — | — | |
| SCHEMBL125137 | 0.69 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108473721-B | Rubber composition and pneumatic tire | 东洋橡胶工业株式会社 | 2020-12-04 | — | — | CN | disclosed |
| US-10723866-B2 | Rubber composition and pneumatic tire | TOYO TIRE CORPORATION (JP) | 2020-07-28 | — | — | US | disclosed |
| US-20180346694-A1 | RUBBER COMPOSITION AND PNEUMATIC TIRE | TOYO TIRE & RUBBER CO., LTD. (JP) | 2018-12-06 | — | — | US | disclosed |
| US-9708477-B2 | Copolymer, rubber composition and pneumatic tire | TOYO TIRE & RUBBER CO., LTD. (JP) | 2017-07-18 | — | — | US | disclosed |
| US-20160176999-A1 | COPOLYMER, RUBBER COMPOSITION AND PNEUMATIC TIRE | TOYO TIRE & RUBBER CO., LTD. (JP) | 2016-06-23 | — | — | US | disclosed |