SCHEMBL6465229

SCHEMBL6465229

Cc1ccc(S(=O)(=O)NC(=O)Nc2nc(C)cc(C)n2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.63
LMNA P02545 4/20 0.59
KMT2A Q03164 2/20 0.57
ALDH1A1 P00352 2/20 0.57
TSHR P16473 1/20 0.57
TP53 P04637 1/20 0.56
CA12 O43570 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA4 P22748 1/20 0.56
CA6 P23280 1/20 0.56
CA5A P35218 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 0.56
CA13 Q8N1Q1 1/20 0.56
CA14 Q9ULX7 1/20 0.56
MEN1 O00255 1/20 0.56
GAA P10253 2/20 0.55
PTGS2 P35354 1/20 0.54
PPARG P37231 1/20 0.53

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
SCHEMBL10762436 0.88 TSHR (0.63) KDM4ELMNAALDH1A1TSHRGAA
SCHEMBL7461770 0.84 ALDH1A1 (0.55) KDM4ELMNAKMT2AALDH1A1MEN1
SCHEMBL8702303 0.81 ALOX15 (0.49) KDM4ELMNAKMT2AALDH1A1CA12
SCHEMBL6463108 0.81 LMNA (0.64) KDM4ELMNAKMT2AALDH1A1TP53
SCHEMBL10681939 0.80 NLRP3 (0.56) KDM4ELMNAALDH1A1TSHRGAA
SCHEMBL7516921 0.80 HSD17B10 (0.56) KDM4ELMNAKMT2AALDH1A1MEN1
SCHEMBL5184740 0.79 LMNA (0.69) KDM4ELMNAKMT2AALDH1A1TSHR
SCHEMBL10415106 0.79 GAA (0.55) KDM4ELMNAKMT2AALDH1A1TSHR
SCHEMBL1928662 0.78 CA12 (0.85) LMNAKMT2AALDH1A1TSHRTP53
SCHEMBL6243996 0.78 CA12 (0.85) LMNAKMT2AALDH1A1TSHRTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050255998-A1 Mixture of colour developers CIBA SPECIALTY CHEMICALS CORP. 2005-11-17 US disclosed
US-20050106491-A1 Heat sensitive recording material CIBA SPECIALTY CHEMICALS CORP. 2005-05-19 US disclosed
EP-1480835-A1 HEAT SENSITIVE RECORDING MATERIAL Ciba SC Holding AG (CH) 2004-12-01 EP disclosed
EP-1480836-A1 MIXTURE OF COLOUR DEVELOPERS Ciba SC Holding AG (CH) 2004-12-01 EP disclosed
WO-2003074285-A1 HEAT SENSITIVE RECORDING MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed
WO-2003074284-A1 MIXTURE OF COLOUR DEVELOPERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-12 WO disclosed