SCHEMBL7458934

SCHEMBL7458934

COc1cc(Cl)nc(NC(=O)NS(=O)(=O)c2ncccc2C(O)CCl)n1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.45
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
CDK1 P06493 1/20 0.38
TP53 P04637 1/20 0.37
GLA P06280 1/20 0.37
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CTSA P10619 1/20 0.34
NLRP3 Q96P20 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
SCHEMBL7455377 0.95 GAA (0.50) GAAALDH1A1KDM4ENPC1CDK1
SCHEMBL9269903 0.93 NPC1 (0.42) GAAALDH1A1KDM4ENPC1TP53
SCHEMBL7454655 0.92 GAA (0.45) GAACDK1TP53GLAMAPT
SCHEMBL7464037 0.92 GAA (0.47) GAAALDH1A1KDM4ENPC1CDK1
SCHEMBL7455217 0.86 GAA (0.47) GAAALDH1A1KDM4ENPC1CDK1
SCHEMBL7453942 0.86 GAA (0.53) GAAALDH1A1KDM4ENPC1CDK1
SCHEMBL9274753 0.85 ALDH1A1 (0.42) GAAALDH1A1KDM4ENPC1TP53
SCHEMBL7455302 0.84 ALOX15 (0.41) GAAALDH1A1KDM4ENPC1TP53
SCHEMBL9208572 0.84 ALDH1A1 (0.43) GAAALDH1A1KDM4ENPC1TP53
SCHEMBL9701450 0.83 ALDH1A1 (0.40) GAAALDH1A1KDM4ENPC1TP53

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
EP-0639190-B1 PYRIDINE SULFONYL UREA DERIVATIVES LG CHEM INVESTMENT LTD (KR) 2002-01-09 EP claimed
US-5461026-A Pyridine sulfonyl urea derivatives KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-10-24 US claimed
EP-0639190-A1 PYRIDINE SULFONYL UREA DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1995-02-22 EP claimed
WO-1992014728-A1 PYRIDINE SULFONYL UREA DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-09-03 WO claimed
EP-0639190-B1 PYRIDINE SULFONYL UREA DERIVATIVES LG CHEM INVESTMENT LTD (KR) 2002-01-09 EP disclosed