⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31337760 | 0.70 | — | — | |
| SCHEMBL30372528 | 0.70 | — | — | |
| SCHEMBL14760122 | 0.69 | ALDH1A1 (0.44) | — | |
| SCHEMBL5369837 | 0.69 | — | — | |
| SCHEMBL9410408 | 0.67 | — | — | |
| SCHEMBL22207668 | 0.67 | — | — | |
| SCHEMBL30372721 | 0.65 | — | — | |
| SCHEMBL8468827 | 0.64 | — | — | |
| SCHEMBL3144709 | 0.63 | — | — | |
| SCHEMBL14760155 | 0.63 | TSHR (0.43) | — |
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-105925971-B | Environment-friendly type film agent | 中山市东升镇威尔特表面技术厂 | 2018-02-27 | — | — | CN | disclosed |
| CN-105925971-A | Environmental-friendly coating agent | 中山市东升镇威尔特表面技术厂 | 2016-09-07 | — | — | CN | disclosed |