SCHEMBL13635276

SCHEMBL13635276

Cc1nn(C)cc1CNc1ccc2c(=O)n(-c3ccc(NC(=O)NS(=O)(=O)c4ccc(Cl)s4)cc3)c(=O)[nH]c2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.59
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MAPT P10636 4/20 0.39
KMT2A Q03164 3/20 0.39
NPC1 O15118 2/20 0.39
MEN1 O00255 2/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 3/20 0.34
TP53 P04637 2/20 0.34
FBP1 P09467 1/20 0.33
RXFP1 Q9HBX9 2/20 0.33
ERCC1 P07992 1/20 0.32
FEN1 P39748 1/20 0.32
ERCC4 Q92889 1/20 0.32
PPARG P37231 1/20 0.32
LMNA P02545 1/20 0.32
RECQL P46063 1/20 0.32
ALDH1A1 P00352 2/20 0.31
AKR1C3 P42330 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
SCHEMBL13635168 0.87 P2RY12 (0.61) P2RY12MAPTKMT2AMEN1TP53
SCHEMBL13634810 0.87 P2RY12 (0.62) P2RY12RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL13635273 0.87 P2RY12 (0.60) P2RY12SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL13635078 0.86 P2RY12 (0.65) P2RY12RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL13634932 0.86 P2RY12 (0.63) P2RY12SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL13635110 0.86 P2RY12 (0.66) P2RY12SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL13635063 0.86 P2RY12 (0.61) P2RY12SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL13635262 0.86 P2RY12 (0.64) P2RY12RAB9ASMN1; SMN2MAPTKMT2A
SCHEMBL13635624 0.85 P2RY12 (0.60) P2RY12SMN1; SMN2MAPTKMT2AMEN1
SCHEMBL13635084 0.85 P2RY12 (0.66) P2RY12SMN1; SMN2MAPTKMT2AMEN1

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