⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12374472 | 0.85 | ABL1 (0.36) | — | |
| SCHEMBL23912613 | 0.83 | — | — | |
| SCHEMBL22590698 | 0.83 | TSHR (0.31) | — | |
| SCHEMBL22590666 | 0.82 | — | — | |
| SCHEMBL23912468 | 0.79 | FOLH1 (0.37) | — | |
| SCHEMBL12374470 | 0.76 | ABL1 (0.38) | — | |
| SCHEMBL12374457 | 0.71 | ABL1 (0.40) | — | |
| SCHEMBL21216730 | 0.70 | ABL1 (0.51) | — | |
| SCHEMBL27047910 | 0.69 | ABL1 (0.39) | — | |
| SCHEMBL12405162 | 0.68 | ABL1 (0.37) | — |
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-11141368-B2 | Cosmetic composition, cosmetic treatment method, kit, and compound | L'OREAL (FR) | 2021-10-12 | — | — | US | disclosed |