⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6337166 | 0.94 | SHBG (0.32) | — | |
| SCHEMBL2456822 | 0.89 | ESR1 (0.34) | — | |
| SCHEMBL31570217 | 0.89 | ESR1 (0.34) | — | |
| SCHEMBL29377531 | 0.88 | CNR1 (0.33) | — | |
| SCHEMBL812172 | 0.88 | CNR1 (0.33) | — | |
| SCHEMBL225143 | 0.83 | IDH1 (0.35) | — | |
| SCHEMBL29011481 | 0.81 | NPC1 (0.35) | — | |
| SCHEMBL30367625 | 0.81 | NPC1 (0.35) | — | |
| SCHEMBL3268199 | 0.81 | NPC1 (0.34) | — | |
| SCHEMBL29367588 | 0.81 | NPC1 (0.34) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112512988-A | Radiation curable compositions for coating optical fibers | 帝斯曼知识产权资产管理有限公司 | 2021-03-16 | — | — | CN | disclosed |
| CN-112437761-A | Radiation curable compositions for coating optical fibers and coatings produced therefrom | 帝斯曼知识产权资产管理有限公司 | 2021-03-02 | — | — | CN | disclosed |
| CN-112368313-A | Polyurethane foam or polyether polyol stabilized with benzofuranone-phosphite derivatives | 巴斯夫欧洲公司 | 2021-02-12 | — | — | CN | disclosed |