⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10587895 | 0.90 | KDM5A (0.40) | — | |
| SCHEMBL10587334 | 0.90 | CYP1A2 (0.44) | — | |
| SCHEMBL7950485 | 0.88 | CYP1A2 (0.48) | — | |
| SCHEMBL10588198 | 0.88 | CYP1A2 (0.48) | — | |
| SCHEMBL10586989 | 0.88 | CYP1A2 (0.48) | — | |
| SCHEMBL8555451 | 0.83 | — | — | |
| SCHEMBL7863957 | 0.81 | KDM5A (0.53) | — | |
| SCHEMBL28835644 | 0.81 | KDM5A (0.41) | — | |
| SCHEMBL4612433 | 0.79 | — | — | |
| SCHEMBL29193847 | 0.79 | KDM5A (0.53) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0319316-A2 | Griseolic acid monoesters, their preparation and use | SANKYO COMPANY LIMITED (JP) | 1989-06-07 | — | — | EP | disclosed |