⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13949324 | 0.74 | — | — | |
| SCHEMBL17322974 | 0.73 | — | — | |
| SCHEMBL17490769 | 0.73 | — | — | |
| SCHEMBL9975623 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL16173970 | 0.69 | TSHR (0.41) | — | |
| SCHEMBL13949323 | 0.67 | TSHR (0.32) | — | |
| SCHEMBL13949560 | 0.67 | — | — | |
| SCHEMBL9750727 | 0.67 | MAPK1 (0.31) | — | |
| SCHEMBL13595286 | 0.66 | FDPS (0.37) | — | |
| Methyl Alcohol SCHEMBL28414164 | 0.65 | ALDH1A1 (0.38) | — |
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-8202893-B2 | Cannabinergic lipid ligands | UNIVERSITY OF CONNECTICUT (US) | 2012-06-19 | — | — | US | disclosed |
| US-7589220-B2 | Enzyme inhibitors for anandamide transporter and pharmacological use with urea, amide, thiourea or other groups | UNIVERSITY OF CONNECTICUT (US) | 2009-09-15 | — | — | US | disclosed |
| US-20090163557-A1 | Cannabinergic Lipid Ligands | NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR | 2009-06-25 | — | — | US | disclosed |