SCHEMBL13634949

SCHEMBL13634949

O=C(Nc1ccc(-n2c(=O)[nH]c3cc(NCc4cc(Br)cs4)ccc3c2=O)cc1)NS(=O)(=O)c1ccc(Cl)s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.60
FBP1 P09467 1/20 0.37
MAPT P10636 4/20 0.33
TP53 P04637 2/20 0.33
RXFP1 Q9HBX9 2/20 0.32
HTR3A P46098 2/20 0.31
MEN1 O00255 3/20 0.30
KMT2A Q03164 3/20 0.30
ERCC1 P07992 1/20 0.30
FEN1 P39748 1/20 0.30
ERCC4 Q92889 1/20 0.30
LMNA P02545 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
HTT P42858 1/20 0.30
RECQL P46063 1/20 0.30
PTPN2 P17706 2/20 0.30
PTPN1 P18031 2/20 0.30
PTPN5 P54829 2/20 0.30
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30

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
SCHEMBL13635167 0.93 P2RY12 (0.61) P2RY12FBP1MAPTTP53RXFP1
SCHEMBL13634871 0.92 P2RY12 (0.62) P2RY12FBP1MAPTTP53RXFP1
SCHEMBL13635110 0.92 P2RY12 (0.66) P2RY12FBP1MAPTTP53RXFP1
SCHEMBL13635048 0.91 P2RY12 (0.64) P2RY12FBP1MAPTTP53RXFP1
SCHEMBL13635062 0.89 P2RY12 (0.60) P2RY12FBP1MAPTTP53RXFP1
SCHEMBL13635264 0.89 P2RY12 (0.61) P2RY12FBP1MAPTTP53RXFP1
SCHEMBL13635078 0.89 P2RY12 (0.65) P2RY12FBP1MAPTTP53RXFP1
SCHEMBL13635080 0.88 P2RY12 (0.59) P2RY12FBP1MAPTTP53RXFP1
SCHEMBL13635267 0.88 P2RY12 (0.60) P2RY12FBP1MAPTTP53RXFP1
SCHEMBL13634930 0.88 P2RY12 (0.62) P2RY12FBP1MAPTTP53RXFP1

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