⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8930434 | 0.90 | — | — | |
| SCHEMBL1631 | 0.89 | — | — | |
| SCHEMBL61116 | 0.89 | — | — | |
| SCHEMBL1632 | 0.89 | — | — | |
| SCHEMBL11036825 | 0.84 | — | — | |
| Propene SCHEMBL23236431 | 0.78 | — | — | |
| Propene SCHEMBL1095311 | 0.78 | — | — | |
| Propene SCHEMBL1095309 | 0.78 | — | — | |
| Propene SCHEMBL23236429 | 0.78 | — | — | |
| Propene SCHEMBL8064619 | 0.78 | — | — |
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-5658908-A | RECEPTOR BINDING SPECIES FOR MEDIATING ANALGESIA, COMBATTING DRUG ADDICTION, DRUG OVERDOSE | DELTA PHARMACEUTICALS, INC. (US) | 1997-08-19 | — | — | US | claimed |