SCHEMBL2960150

SCHEMBL2960150

CCCCc1ccc(S(=O)(=O)[O-])cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
CNR2 P34972 1/20 0.50
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46
LMNA P02545 2/20 0.44
TSHR P16473 2/20 0.44
HTT P42858 2/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KCNH2 Q12809 1/20 0.44
HIF1A Q16665 1/20 0.44
HPGD P15428 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HSD17B10 Q99714 1/20 0.44
FFAR1 O14842 1/20 0.43
FFAR4 Q5NUL3 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 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
SCHEMBL2965334 0.94 CA2 (0.54) CA2SMN1; SMN2CNR2LMNATSHR
SCHEMBL2955495 0.94 CA2 (0.54) CA2SMN1; SMN2CNR2LMNATSHR
SCHEMBL2963870 0.93 CNR2 (0.57) CA2SMN1; SMN2CNR2KEAP1NFE2L2
SCHEMBL2964979 0.89 ALDH1A1 (0.46) CA2SMN1; SMN2CNR2ALDH1A1
SCHEMBL2967119 0.88 KCNH2 (0.58) CA2SMN1; SMN2CNR2LMNATSHR
SCHEMBL2966132 0.88 KCNH2 (0.58) CA2SMN1; SMN2CNR2LMNATSHR
SCHEMBL2958941 0.86 CYP2C9 (0.55) CA2SMN1; SMN2CNR2LMNATSHR
Butylbenzyl SCHEMBL28383301 0.85 CA2 (0.54) CA2SMN1; SMN2CNR2KEAP1NFE2L2
SCHEMBL5419102 0.85 CA2 (0.42) CA2SMN1; SMN2CNR2KEAP1NFE2L2
SCHEMBL111932 0.85 HSD11B1 (0.49) CA2SMN1; SMN2LMNAKCNH2HIF1A

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7759045-B2 Chemically amplified positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-07-20 US disclosed
US-20090004601-A1 Chemically amplified positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-01 US disclosed
US-6893794-B2 Chemical amplification type positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-05-17 US disclosed
US-20040018445-A1 Chemical amplification type positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-01-29 US disclosed
US-20030068573-A1 Chemical amplification type positive resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-04-10 US disclosed