⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4733293 | 1.00 | — | — | |
| SCHEMBL12929195 | 1.00 | — | — | |
| SCHEMBL27841277 | 1.00 | — | — | |
| SCHEMBL13451951 | 0.84 | — | — | |
| SCHEMBL13336386 | 0.84 | — | — | |
| SCHEMBL4509732 | 0.84 | — | — | |
| SCHEMBL12330903 | 0.84 | — | — | |
| SCHEMBL13451997 | 0.84 | — | — | |
| SCHEMBL7715591 | 0.82 | — | — | |
| SCHEMBL14168577 | 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 |
|---|---|---|---|---|---|---|---|
| CN-102448957-A | Compounds as cannabinoid receptor ligands | ABBOTT LAB | 2012-05-09 | — | — | CN | disclosed |
| CN-102216277-A | Substituted benzamides as cannabinoid receptor ligands | ABBOTT LAB | 2011-10-12 | — | — | CN | disclosed |
| WO-2010085377-A2 | HYDROXAMIC ACID DERIVATIVES | CRYSTAL BIOPHARMACEUTICAL LLC (US) | 2010-07-29 | — | — | WO | disclosed |