⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24221051 | 0.78 | — | — | |
| SCHEMBL17813254 | 0.76 | SOS1 (0.31) | — | |
| SCHEMBL19120824 | 0.75 | MCHR1 (0.33) | — | |
| SCHEMBL22142715 | 0.75 | MCHR1 (0.33) | — | |
| SCHEMBL25044485 | 0.75 | — | — | |
| SCHEMBL19069659 | 0.74 | ROCK2 (0.31) | — | |
| SCHEMBL23063449 | 0.73 | TSHR (0.36) | — | |
| SCHEMBL17722846 | 0.71 | — | — | |
| SCHEMBL22813067 | 0.71 | ALDH1A1 (0.31) | — | |
| SCHEMBL23570376 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023018648-A1 | PHENOL DERIVATIVES FOR USE IN THE MODULATION OF BRM | GENENTECH, INC. (US) | 2023-02-16 | — | — | WO | disclosed |
| US-10966987-B2 | Therapeutic compounds and uses thereof | KALA PHARMACEUTICALS, INC. (US) | 2021-04-06 | — | — | US | disclosed |
| US-20200054644-A1 | THERAPEUTIC COMPOUNDS AND USES THEREOF | KALA BIO, Inc. | 2020-02-20 | — | — | US | disclosed |