⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13011027 | 0.75 | — | — | |
| SCHEMBL15462384 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL25245415 | 0.72 | MEN1 (0.34) | — | |
| SCHEMBL24834701 | 0.71 | — | — | |
| SCHEMBL25216100 | 0.70 | CNR2 (0.53) | — | |
| SCHEMBL16633956 | 0.70 | OPRM1 (0.40) | — | |
| SCHEMBL16633959 | 0.70 | OPRM1 (0.40) | — | |
| SCHEMBL16633957 | 0.70 | OPRM1 (0.40) | — | |
| SCHEMBL25227238 | 0.69 | OPRM1 (0.47) | — | |
| SCHEMBL13677475 | 0.68 | CYP19A1 (0.40) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240239761-A1 | BICYCLIC PHENOL COMPOUNDS AND USE THEREOF | MEDSHINE DISCOVERY INC. (CN) | 2024-07-18 | — | — | US | disclosed |