⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4215300 | 0.79 | — | — | |
| SCHEMBL1114260 | 0.75 | CA12 (0.32) | — | |
| SCHEMBL6533266 | 0.65 | BCL2L1 (0.31) | — | |
| SCHEMBL1114110 | 0.62 | CA2 (0.36) | — | |
| SCHEMBL1700282 | 0.58 | MAPT (0.50) | — | |
| SCHEMBL1700017 | 0.58 | MAPT (0.50) | — | |
| SCHEMBL1112453 | 0.58 | KDM1A (0.47) | — | |
| SCHEMBL1546166 | 0.56 | HDAC4 (0.51) | — | |
| Hydrochloric Acid SCHEMBL6582044 | 0.56 | KMT2A (0.67) | — | |
| SCHEMBL7899199 | 0.56 | SLC18A3 (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2279174-A2 | ARYLSULFONAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF USE | Genentech, Inc. (US) | 2011-02-02 | — | — | EP | disclosed |
| WO-2009143246-A2 | ARYLSULFONAMIDE COMPOUNDS, COMPOSITIONS AND METHODS OF USE | GENENTECH, INC. (US) | 2009-11-26 | — | — | WO | disclosed |