SCHEMBL8896463

SCHEMBL8896463

CCCCCCc1ccc(CCC(NS(=O)(=O)c2ccc(Cl)cc2)c2ccc(CCCC(=O)OC)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.44
CYP2C9 P11712 2/20 0.42
TSHR P16473 2/20 0.42
CYP2C19 P33261 2/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPK1 P28482 1/20 0.42
PPARA Q07869 1/20 0.41
TBXA2R P21731 1/20 0.40
TBXAS1 P24557 1/20 0.40
AKT1 P31749 2/20 0.40
IRS1 P35568 2/20 0.40
GAB1 Q13480 2/20 0.40
LMNA P02545 1/20 0.40
CYP2D6 P10635 1/20 0.40
HTT P42858 1/20 0.40
KCNH2 Q12809 1/20 0.40
HIF1A Q16665 1/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL8898667 1.00 UTS2R (0.44) UTS2RCYP2C9TSHRCYP2C19ALDH1A1
SCHEMBL8895435 0.99 UTS2R (0.45) UTS2RCYP2C9TSHRCYP2C19ALDH1A1
SCHEMBL8896098 0.96 UTS2R (0.46) UTS2RCYP2C9TSHRCYP2C19ALDH1A1
SCHEMBL8895286 0.95 UTS2R (0.45) UTS2RCYP2C9TSHRCYP2C19ALDH1A1
SCHEMBL8895738 0.95 UTS2R (0.45) UTS2RCYP2C9TSHRCYP2C19ALDH1A1
SCHEMBL8897125 0.95 UTS2R (0.45) UTS2RCYP2C9TSHRCYP2C19ALDH1A1
SCHEMBL8896086 0.95 UTS2R (0.45) UTS2RCYP2C9TSHRCYP2C19ALDH1A1
SCHEMBL8897166 0.94 UTS2R (0.46) UTS2RCYP2C9TSHRCYP2C19ALDH1A1
SCHEMBL8897066 0.94 UTS2R (0.49) UTS2RCYP2C9TSHRCYP2C19ALDH1A1
SCHEMBL8896622 0.93 UTS2R (0.45) UTS2RCYP2C9TSHRCYP2C19ALDH1A1

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
US-5597848-A PLATELET AGGREGATION INHIBITORS, ANTITHROMBOTIC AGENTS, ANTIASTHMATIC AGENTS, ANTIALLERGIC AGENTS HOKURIKU SEIYAKU CO., LTD. (JP) 1997-01-28 US disclosed
EP-0663392-A1 BENZENESULFONAMIDE DERIVATIVE AND USE THEREOF HOKURIKU SEIYAKU CO., LTD. (JP) 1995-07-19 EP disclosed