⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2946601 | 0.90 | TRPV1 (0.47) | — | |
| SCHEMBL2946603 | 0.90 | TRPV1 (0.47) | — | |
| SCHEMBL2956168 | 0.81 | — | — | |
| SCHEMBL2946300 | 0.77 | TRPV1 (0.53) | — | |
| SCHEMBL2948908 | 0.77 | TRPV1 (0.53) | — | |
| SCHEMBL5802773 | 0.75 | — | — | |
| SCHEMBL5275116 | 0.75 | TRPV1 (0.54) | — | |
| SCHEMBL5279100 | 0.75 | TRPV1 (0.54) | — | |
| SCHEMBL2006323 | 0.73 | TRPV1 (0.53) | — | |
| SCHEMBL2956170 | 0.73 | TRPV1 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1861357-B1 | NOVEL COMPOUNDS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF AS VANILLOID RECEPTOR ANTAGONIST; AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME | AMOREPACIFIC CORP (KR) | 2013-04-24 | — | — | EP | disclosed |