SCHEMBL6424798

SCHEMBL6424798

CC(C)c1ccc(S(=O)(=O)n2c(-c3ccccc3)c(O)c3ccccc32)c(Br)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 6/20 0.45
AGTR1 P30556 2/20 0.40
MCL1 Q07820 1/20 0.36
FABP3 P05413 2/20 0.36
FABP4 P15090 2/20 0.36
FABP5 Q01469 2/20 0.36
CYP2C19 P33261 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HTR6 P50406 3/20 0.36
PSEN1 P49768 1/20 0.36
PSEN2 P49810 1/20 0.36
APH1B Q8WW43 1/20 0.36
NCSTN Q92542 1/20 0.36
APH1A Q96BI3 1/20 0.36
PSENEN Q9NZ42 1/20 0.36
NOD1 Q9Y239 1/20 0.34
LMNA P02545 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
FABP2 P12104 1/20 0.34

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
SCHEMBL6422478 0.85 ACLY (0.41) ACLYMCL1FABP3FABP4FABP5
SCHEMBL6420752 0.85 AGTR1 (0.50) ACLYAGTR1FABP3FABP4FABP5
SCHEMBL3553704 0.82 FABP3 (0.47) ACLYAGTR1FABP3FABP4FABP5
SCHEMBL14953515 0.77 ACLY (0.54) ACLYKMT2A
SCHEMBL6820925 0.74 BCL2 (0.40) AGTR1MCL1CYP2C19HSD17B10LMNA
SCHEMBL14953494 0.74 ACLY (0.43) ACLYFABP4HSD17B10HTR6NOD1
SCHEMBL3557485 0.74 AGTR1 (0.58) ACLYAGTR1FABP3FABP4FABP5
SCHEMBL6437617 0.70 ACLY (0.43) ACLYAGTR1FABP3FABP4FABP5
SCHEMBL3562443 0.68 ACLY (0.50) ACLYAGTR1HTR6LMNA
SCHEMBL3556363 0.67 HTR6 (0.49) ACLYFABP3FABP4FABP5CYP2C19

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
EP-1567492-B1 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES SUVEN LIFE SCIENCES LTD (IN) 2013-05-22 EP disclosed
EP-1567492-A2 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES Suven Life Sciences Limited (IN) 2005-08-31 EP disclosed
WO-2004048328-A2 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES SUVEN LIFE SCIENCES LIMITED (IN) 2004-06-10 WO disclosed