⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9903450 | 0.79 | CYP2C9 (0.30) | — | |
| SCHEMBL12774650 | 0.79 | PIP4K2C (0.32) | — | |
| SCHEMBL6929396 | 0.73 | TRPV4 (0.41) | — | |
| SCHEMBL11538318 | 0.73 | GPR35 (0.37) | — | |
| SCHEMBL11502295 | 0.68 | CHEK1 (0.38) | — | |
| SCHEMBL7031240 | 0.68 | KDM4E (0.44) | — | |
| SCHEMBL2222399 | 0.67 | CCR4 (0.41) | — | |
| SCHEMBL3037140 | 0.67 | KDM4E (0.31) | — | |
| SCHEMBL23569409 | 0.64 | KDM4E (0.33) | — | |
| SCHEMBL6286677 | 0.64 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1780829-B | Fluorine-containing and trifluoroalkyl heterocyclic sulfonamide inhibitors of beta amyloid production and derivatives thereof | WYETH CORP | 2010-12-29 | — | — | CN | disclosed |
| CN-101274926-A | Fluoro-and trifluoroalkyl-containing heterocyclic sulfonamide inhibitors of beta amyloid production and derivatives thereof | WYETH CORP (US) | 2008-10-01 | — | — | CN | disclosed |
| CN-101208299-A | Diarylsulfone sulfonamides and use therof | WYETH CORP (US) | 2008-06-25 | — | — | CN | disclosed |
| CN-1780829-A | Fluorine-containing and trifluoroalkyl heterocyclic sulfonamide inhibitors of beta amyloid production and derivatives thereof | WYETH CORP (US) | 2006-05-31 | — | — | CN | disclosed |
| EP-1599202-A1 | TETRACYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | Pharmacia Italia S.p.A. (IT) | 2005-11-30 | — | — | EP | disclosed |
| EP-1126833-A4 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES INC (US) | 2004-09-08 | — | — | EP | disclosed |
| WO-2004071507-A1 | TETRACYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM | PHARMACIA ITALIA S.P.A. (IT) | 2004-08-26 | — | — | WO | disclosed |
| EP-1126833-A2 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2001-08-29 | — | — | EP | disclosed |
| WO-2000025768-A1 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2000-05-11 | — | — | WO | disclosed |