⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18832098 | 0.80 | LPAR3 (0.37) | — | |
| SCHEMBL28212218 | 0.80 | TSHR (0.31) | — | |
| SCHEMBL16804353 | 0.79 | TSHR (0.31) | — | |
| SCHEMBL9327121 | 0.78 | PPARD (0.48) | — | |
| SCHEMBL10880951 | 0.78 | PPARD (0.30) | — | |
| SCHEMBL135560 | 0.74 | — | — | |
| SCHEMBL10880461 | 0.74 | CTSA (0.31) | — | |
| SCHEMBL20875719 | 0.72 | LPAR3 (0.43) | — | |
| SCHEMBL28933751 | 0.71 | — | — | |
| SCHEMBL4262691 | 0.71 | PPARD (0.45) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108137715-B | Method for preparing functionalized polymers | 株式会社普利司通 | 2021-01-22 | — | — | CN | claimed |
| CN-108137715-B | Method for preparing functionalized polymers | 株式会社普利司通 | 2021-01-22 | — | — | CN | disclosed |