SCHEMBL13633801

SCHEMBL13633801

CNc1ccc2c(=O)n(-c3c(F)cc(NC(=O)NS(=O)(=O)c4ccc(Cl)s4)cc3C(F)F)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.47
FBP1 P09467 1/20 0.34
MAPT P10636 1/20 0.33
CCR4 P51679 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31

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
SCHEMBL9922990 0.93 P2RY12 (0.51) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL13638633 0.92 P2RY12 (0.39) P2RY12MEN1KMT2A
SCHEMBL12161667 0.91 P2RY12 (0.49) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL9922995 0.89 P2RY12 (0.48) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL14228344 0.88 P2RY12 (0.47) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL9922992 0.88 P2RY12 (0.47) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL9922112 0.86 P2RY12 (0.53) P2RY12FBP1MAPTMEN1KMT2A
SCHEMBL13633802 0.86 P2RY12 (0.43) P2RY12FBP1MAPTCCR4MEN1
SCHEMBL13638632 0.85 P2RY12 (0.42) P2RY12MEN1KMT2A
SCHEMBL9922997 0.83 P2RY12 (0.48) P2RY12FBP1MAPTMEN1KMT2A

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