⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL303054 | 1.00 | — | — | |
| SCHEMBL1779485 | 1.00 | — | — | |
| SCHEMBL4800650 | 0.97 | TSHR (0.42) | — | |
| SCHEMBL6519587 | 0.97 | TSHR (0.42) | — | |
| SCHEMBL6468322 | 0.89 | TSHR (0.37) | — | |
| SCHEMBL6523128 | 0.80 | TSHR (0.34) | — | |
| SCHEMBL4297438 | 0.80 | SLC18A3 (0.40) | — | |
| SCHEMBL779515 | 0.78 | SLC18A3 (0.43) | — | |
| SCHEMBL1929909 | 0.77 | SLC18A3 (0.41) | — | |
| SCHEMBL17054528 | 0.73 | MAOB (0.33) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8357711-B2 | Heterocyclic sulfonamides as inhibitors of ion channels | PFIZER LIMITED (GB) | 2013-01-22 | — | — | US | disclosed |
| US-8163735-B2 | Sulfonamide compounds as cysteine protease inhibitors | VIROBAY, INC. (US) | 2012-04-24 | — | — | US | disclosed |
| US-20110166132-A1 | Gamma Secretase Modulators | AMGEN INC. (US) | 2011-07-07 | — | — | US | disclosed |
| US-20090143358-A1 | INHIBITORS OF ION CHANNELS | ICAGEN, INC. (US) | 2009-06-04 | — | — | US | disclosed |
| US-20060293374-A1 | Substituted isothiazolones | JANSSEN PHARMACEUTICA N.V. (BE) | 2006-12-28 | — | — | US | disclosed |