SCHEMBL4445805

SCHEMBL4445805

COc1ccc(CNS(=O)(=O)c2cccc3c(NC(C)=O)cccc23)c(OC)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.47
NSD2 O96028 2/20 0.47
ALDH1A1 P00352 3/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
FABP4 P15090 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
LMNA P02545 1/20 0.43
EDNRA P25101 1/20 0.43

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
SCHEMBL4445447 0.88 ALDH1A1 (0.46) NSD2ALDH1A1MEN1KMT2AFABP4
SCHEMBL4452477 0.87 MEN1 (0.48) TP53HTTMEN1KMT2AFABP4
SCHEMBL4443167 0.84 NSD2 (0.55) NSD2ALDH1A1MEN1KMT2AFABP4
SCHEMBL4453211 0.84 NSD2 (0.52) TP53NSD2ALDH1A1FABP4SMN1; SMN2
SCHEMBL4444987 0.84 NSD2 (0.66) NSD2ALDH1A1MEN1KMT2AFABP4
SCHEMBL4449293 0.83 MEN1 (0.45) ALDH1A1MEN1KMT2AFABP4SMN1; SMN2
SCHEMBL6907327 0.83 CASP6 (0.54) TP53ALDH1A1HPGDHTTMEN1
SCHEMBL4453000 0.83 NSD2 (0.53) NSD2ALDH1A1FABP4SMN1; SMN2EDNRA
SCHEMBL4454783 0.82 NSD2 (0.69) TP53NSD2ALDH1A1
SCHEMBL4444610 0.81 FABP4 (0.51) NSD2ALDH1A1FABP4EDNRA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7547716-B2 Sulfonamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-06-16 US disclosed
EP-1402890-B1 SULFONAMIDE DERIVATIVES INST MED MOLECULAR DESIGN INC (JP) 2008-01-09 EP disclosed
EP-1402890-A1 SULFONAMIDE DERIVATIVES Institute of Medicinal Molecular Design, Inc. (JP) 2004-03-31 EP disclosed