⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3029136 | 0.72 | — | — | |
| SCHEMBL11047704 | 0.66 | THRB (0.38) | — | |
| SCHEMBL303875 | 0.65 | — | — | |
| SCHEMBL10984502 | 0.64 | — | — | |
| SCHEMBL17636435 | 0.63 | — | — | |
| SCHEMBL10034732 | 0.63 | — | — | |
| SCHEMBL7929723 | 0.63 | — | — | |
| SCHEMBL10582604 | 0.63 | CA1 (0.31) | — | |
| SCHEMBL21827304 | 0.62 | — | — | |
| SCHEMBL21751920 | 0.62 | — | — |
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-20100120791-A1 | CYCLOHEXYL SULFONAMIDE DERIVATIVES | NETTEKOVEN MATTHIAS | 2010-05-13 | — | — | US | disclosed |
| US-20070173511-A1 | Cyclohexyl sulfonamide derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 2007-07-26 | — | — | US | disclosed |