SCHEMBL3702898

SCHEMBL3702898

Cc1cc(OC(F)(F)F)ccc1C(=O)Nc1ccc(Oc2ccc3cc(C(=O)N4CCN(C(=O)OC(C)(C)C)CC4)n(C)c3c2)nc1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 18/20 0.45
SCN9A Q15858 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL3061624 0.92 STAT3 (0.48) STAT3SCN9A
SCHEMBL3056966 0.92 STAT3 (0.51) STAT3SCN9A
SCHEMBL3050627 0.87 STAT3 (0.54) STAT3SCN9A
SCHEMBL3056483 0.86 STAT3 (0.48) STAT3SCN9A
SCHEMBL3057187 0.86 STAT3 (0.45) STAT3
SCHEMBL10182050 0.86 STAT3 (0.48) STAT3SCN9A
SCHEMBL3050694 0.84 STAT3 (0.45) STAT3SCN9A
SCHEMBL3046226 0.83 HRH3 (0.45) STAT3
SCHEMBL3060046 0.83 STAT3 (0.44) STAT3SCN9A
SCHEMBL3062716 0.82 SCN9A (0.51) STAT3SCN9A

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2207773-A2 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF Otsuka Pharmaceutical Co., Ltd. (JP) 2010-07-21 EP disclosed
WO-2009057811-A2 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-05-07 WO disclosed