SCHEMBL8962452

SCHEMBL8962452

CCCCCCCCCCCCSC(=O)CS(=O)(=O)Nc1c(OC)cc(OC)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
TP53 P04637 1/20 0.48
CYP3A4 P08684 1/20 0.48
MAPT P10636 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
ACAT1 P24752 1/20 0.48
SOAT1 P35610 1/20 0.48

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
SCHEMBL9063039 0.76 MAPT (0.40) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL1122340 0.76 MAPT (0.43) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8962453 0.74 MAPT (0.42) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8963355 0.74 MAPT (0.44) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL9063047 0.72 MAPT (0.40) KDM4ETP53CYP3A4MAPTALOX15
SCHEMBL8962767 0.72
SCHEMBL8962505 0.72
SCHEMBL8962555 0.72
SCHEMBL8962527 0.72
SCHEMBL8962482 0.72

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
WO-1996019446-A1 β-CARBOXY SULFONAMIDE ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 1996-06-27 WO claimed
US-5491170-A TREATMENT OF HYPERCHOLESTEROLEMIA AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 1996-02-13 US disclosed