⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27648162 | 0.66 | — | — | |
| SCHEMBL24060448 | 0.66 | — | — | |
| SCHEMBL27419992 | 0.62 | — | — | |
| SCHEMBL6754803 | 0.60 | POLB (0.30) | — | |
| SCHEMBL3684282 | 0.60 | — | — | |
| SCHEMBL27913643 | 0.58 | — | — | |
| SCHEMBL16343835 | 0.58 | — | — | |
| SCHEMBL23725984 | 0.57 | — | — | |
| SCHEMBL4652332 | 0.55 | — | — | |
| SCHEMBL28574342 | 0.54 | — | — |
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-0088619-A2 | Benzopyrans | THE UPJOHN COMPANY (US) | 1983-09-14 | — | — | EP | disclosed |