⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5473305 | 0.77 | GRM5 (0.34) | — | |
| SCHEMBL7897372 | 0.77 | SRD5A1 (0.39) | — | |
| SCHEMBL27873730 | 0.77 | SRD5A1 (0.39) | — | |
| SCHEMBL159742 | 0.77 | SRD5A1 (0.39) | — | |
| SCHEMBL168071 | 0.73 | PARP10 (0.40) | — | |
| SCHEMBL27873727 | 0.73 | PARP10 (0.40) | — | |
| SCHEMBL1857350 | 0.73 | PARP10 (0.40) | — | |
| SCHEMBL296542 | 0.68 | KDM4E (0.41) | — | |
| SCHEMBL17190969 | 0.68 | PARP1 (0.41) | — | |
| SCHEMBL7897504 | 0.67 | KDM4E (0.31) | — |
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-20120277190-A1 | PRODRUGS OF COMPOUNDS THAT INHIBIT TRPV1 RECEPTOR | ABBVIE INC. | 2012-11-01 | — | — | US | disclosed |
| US-8232309-B2 | Prodrugs of compounds that inhibit TRPV1 receptor | ABBOTT LABORATORIES (US) | 2012-07-31 | — | — | US | disclosed |
| US-20070099954-A1 | Prodrugs of compounds that inhibit TRPV1 receptor | ABBVIE INC. | 2007-05-03 | — | — | US | disclosed |