SCHEMBL13638508

SCHEMBL13638508

O=C(Nc1ccc(-n2c(=O)[nH]c3c4c(ccc3c2=O)NCC4)c(Cl)c1)NS(=O)(=O)C1=CCC(Cl)S1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.33

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
SCHEMBL9922883 0.84 P2RY12 (0.49) P2RY12
SCHEMBL12177231 0.79 P2RY12 (0.50) P2RY12
SCHEMBL13638702 0.79 P2RY12 (0.38) P2RY12
SCHEMBL9922856 0.77 P2RY12 (0.53) P2RY12
SCHEMBL9923203 0.77 PPARG (0.36) P2RY12
SCHEMBL14113770 0.75 P2RY12 (0.37) P2RY12
SCHEMBL9923168 0.75
SCHEMBL9922467 0.73 P2RY12 (0.57) P2RY12
SCHEMBL12177072 0.72 CA12 (0.35) P2RY12
SCHEMBL12177258 0.71 HPD (0.34) P2RY12

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7622474-B2 Asulfonyl(urea, thiourea, guanidine, cyanoguanidine) compounds; cardiovascular disorders; thrombosis PORTOLA PHARMACEUTICALS, INC. (US) 2009-11-24 US disclosed