⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5244737 | 1.00 | — | — | |
| SCHEMBL19853430 | 0.85 | CHRNB2 (0.44) | — | |
| SCHEMBL14586896 | 0.83 | MAPT (0.44) | — | |
| SCHEMBL18650145 | 0.83 | CHRNB2 (0.48) | — | |
| SCHEMBL13347915 | 0.83 | CHRNB2 (0.45) | — | |
| SCHEMBL967608 | 0.83 | — | — | |
| SCHEMBL20501573 | 0.82 | CHRNB2 (0.44) | — | |
| SCHEMBL21602806 | 0.81 | CHRNB2 (0.50) | — | |
| SCHEMBL15249606 | 0.80 | CHRNB2 (0.46) | — | |
| SCHEMBL24358579 | 0.79 | MAPT (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8202893-B2 | Cannabinergic lipid ligands | UNIVERSITY OF CONNECTICUT (US) | 2012-06-19 | — | — | US | disclosed |
| US-20090163557-A1 | Cannabinergic Lipid Ligands | NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR | 2009-06-25 | — | — | US | disclosed |