SCHEMBL7572140

SCHEMBL7572140

CC(C)c1ccc(S(=O)(=O)Nc2cccc3ccccc23)cc1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.69
KMT2A Q03164 6/20 0.65
MEN1 O00255 5/20 0.65
ALDH1A1 P00352 2/20 0.65
MAPT P10636 2/20 0.65
LMNA P02545 1/20 0.59
HTT P42858 1/20 0.59
KEAP1 Q14145 7/20 0.55
NFE2L2 Q16236 6/20 0.53
ALOX12 P18054 2/20 0.51
GAA P10253 1/20 0.50
POLB P06746 1/20 0.49
CASP6 P55212 1/20 0.49
MCL1 Q07820 1/20 0.49
SQSTM1 Q13501 1/20 0.49
HTR1A P08908 1/20 0.47
HTR2A P28223 1/20 0.47
HTR7 P34969 1/20 0.47
HTR6 P50406 1/20 0.47

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
SCHEMBL7588944 0.86 ALDH1A1 (0.56) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL164503 0.83 RECQL (0.76) RECQLKMT2AMEN1ALDH1A1MAPT
SCHEMBL7573136 0.83 KEAP1 (0.76) RECQLKMT2AMEN1ALDH1A1MAPT
SCHEMBL7571609 0.83 MAPT (0.54) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL1428546 0.82 RECQL (1.00) RECQLKMT2AMEN1ALDH1A1MAPT
SCHEMBL23555160 0.80 ALDH1A1 (0.71) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL9942077 0.80 RECQL (0.71) RECQLKMT2AMEN1ALDH1A1MAPT
SCHEMBL7537943 0.80 RECQL (0.76) RECQLKMT2AMEN1ALDH1A1MAPT
SCHEMBL7578880 0.80 KEAP1 (0.76) RECQLKMT2AMEN1ALDH1A1MAPT
SCHEMBL18434691 0.79 KEAP1 (0.78) RECQLKMT2AMEN1ALDH1A1MAPT

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-1239852-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS Arrow Therapeutics Limited (GB) 2002-09-18 EP disclosed
WO-2001028537-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS ARROW THERAPEUTICS LIMITED (GB) 2001-04-26 WO disclosed