⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28157041 | 0.87 | HTR6 (0.34) | — | |
| SCHEMBL28247417 | 0.73 | HTR6 (0.32) | — | |
| SCHEMBL31210055 | 0.70 | HTR6 (0.46) | — | |
| SCHEMBL31209074 | 0.70 | HTR6 (0.46) | — | |
| SCHEMBL15133788 | 0.70 | HTR6 (0.46) | — | |
| SCHEMBL20523424 | 0.69 | HTR6 (0.44) | — | |
| SCHEMBL4822887 | 0.69 | MEN1 (0.38) | — | |
| SCHEMBL26646493 | 0.69 | MEN1 (0.38) | — | |
| SCHEMBL16109047 | 0.69 | DPP4 (0.31) | — | |
| SCHEMBL12339302 | 0.69 | DPP4 (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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100120769-A1 | CYCLOHEXYL PIPERAZINYL METHANONE DERIVATIVES | NETTEKOVEN MATTHIAS | 2010-05-13 | — | — | US | disclosed |
| 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 |
| US-20070167436-A1 | Cyclohexyl piperazinyl methanone derivatives | HOFFMANN-LA ROCHE INC. | 2007-07-19 | — | — | US | disclosed |