⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8273222 | 1.00 | — | — | |
| SCHEMBL879525 | 1.00 | — | — | |
| SCHEMBL22924844 | 0.85 | — | — | |
| SCHEMBL18570284 | 0.79 | — | — | |
| SCHEMBL22924841 | 0.79 | — | — | |
| SCHEMBL237033 | 0.79 | — | — | |
| SCHEMBL237034 | 0.79 | — | — | |
| SCHEMBL20787016 | 0.78 | ALDH1A1 (0.32) | — | |
| SCHEMBL13980458 | 0.78 | — | — | |
| SCHEMBL12831630 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1539693-B9 | CANNABINOID RECEPTOR AGONISTS | SCHERING CORP (US) | 2008-10-08 | — | — | EP | disclosed |
| EP-1539693-B1 | CANNABINOID RECEPTOR AGONISTS | SCHERING CORP (US) | 2008-03-12 | — | — | EP | disclosed |