SCHEMBL13635282

SCHEMBL13635282

O=C(Nc1ccc(-n2c(=O)[nH]c3cc(NCc4ccc(Cl)nc4)ccc3c2=O)cc1)NS(=O)(=O)c1ccc(Cl)s1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 2/20 0.60
FBP1 P09467 1/20 0.38
NAMPT P43490 3/20 0.37
CYP2C9 P11712 2/20 0.37
TP53 P04637 3/20 0.34
MAPT P10636 3/20 0.34
RXFP1 Q9HBX9 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HSP90AA1 P07900 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
HDAC1 Q13547 1/20 0.32
CYP3A4 P08684 2/20 0.31
CYP2C19 P33261 2/20 0.31
RECQL P46063 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MALT1 Q9UDY8 1/20 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
SCHEMBL13635048 0.90 P2RY12 (0.64) P2RY12FBP1CYP2C9TP53MAPT
SCHEMBL13635072 0.90 P2RY12 (0.64) P2RY12FBP1CYP2C9TP53MAPT
SCHEMBL13635172 0.89 P2RY12 (0.59) P2RY12NAMPTCYP2C9MEN1KMT2A
SCHEMBL13635262 0.89 P2RY12 (0.64) P2RY12FBP1TP53MAPTRXFP1
SCHEMBL13635114 0.89 P2RY12 (0.66) P2RY12FBP1TP53MAPTRXFP1
SCHEMBL13634834 0.89 P2RY12 (0.62) P2RY12FBP1TP53MAPTRXFP1
SCHEMBL13635261 0.89 P2RY12 (0.64) P2RY12TP53MAPTRXFP1MEN1
SCHEMBL13635056 0.88 P2RY12 (0.61) P2RY12FBP1TP53MAPTRXFP1
SCHEMBL13635061 0.88 P2RY12 (0.61) P2RY12FBP1TP53MAPTRXFP1
SCHEMBL13635110 0.88 P2RY12 (0.66) P2RY12FBP1TP53MAPTRXFP1

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
EP-1668002-B1 2,4-DIOXO-3-QUINAZOLINYLARYL SULFONYLUREAS PORTOLA PHARM INC (US) 2009-11-11 EP disclosed