⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL807629 | 0.76 | HTR3A (0.38) | — | |
| SCHEMBL7638669 | 0.72 | — | — | |
| SCHEMBL13767655 | 0.72 | SLC18A3 (0.36) | — | |
| SCHEMBL23182676 | 0.70 | DRD2 (0.36) | — | |
| SCHEMBL14208047 | 0.70 | HTR6 (0.36) | — | |
| SCHEMBL7641181 | 0.69 | — | — | |
| SCHEMBL7641174 | 0.69 | — | — | |
| SCHEMBL7640406 | 0.68 | — | — | |
| SCHEMBL7640409 | 0.68 | — | — | |
| SCHEMBL7642205 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010123139-A1 | ARYLCARBOXAMIDE DERIVATIVE HAVING SULFAMOYL GROUP | 持田製薬株式会社 (JP) | 2010-10-28 | — | — | WO | disclosed |