⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9601342 | 0.86 | — | — | |
| SCHEMBL13532586 | 0.85 | HTR1A (0.50) | — | |
| SCHEMBL9601156 | 0.85 | — | — | |
| SCHEMBL9823024 | 0.84 | — | — | |
| SCHEMBL9526990 | 0.84 | — | — | |
| SCHEMBL9600927 | 0.83 | HTR1A (0.44) | — | |
| SCHEMBL9526698 | 0.83 | DRD2 (0.52) | — | |
| SCHEMBL9527982 | 0.82 | — | — | |
| SCHEMBL9601268 | 0.82 | HTR1A (0.42) | — | |
| SCHEMBL9526324 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4748240-A | Psychotropic bicyclic imides | AMERICAN HOME PRODUCTS CORPORATION (US) | 1988-05-31 | — | — | US | claimed |
| EP-0309544-B1 | PSYCHOTROPIC BICYCLIC IMIDES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1993-02-10 | — | — | EP | disclosed |
| US-4748240-A | Psychotropic bicyclic imides | AMERICAN HOME PRODUCTS CORPORATION (US) | 1988-05-31 | — | — | US | disclosed |