SCHEMBL13635281

SCHEMBL13635281

O=C(Nc1ccc(-n2c(=O)[nH]c3cc(NCc4cc(F)cc(F)c4)ccc3c2=O)cc1)NS(=O)(=O)c1ccc(Cl)s1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.68
MAPT P10636 3/20 0.35
TP53 P04637 3/20 0.35
HTR3A P46098 2/20 0.35
FBP1 P09467 1/20 0.34
RXFP1 Q9HBX9 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
LMNA P02545 2/20 0.33
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
HSP90AA1 P07900 1/20 0.32
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32
PPARG P37231 1/20 0.31
ERCC1 P07992 1/20 0.31
FEN1 P39748 1/20 0.31
ERCC4 Q92889 1/20 0.31
HTT P42858 1/20 0.31
RECQL P46063 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
SCHEMBL13635114 0.94 P2RY12 (0.66) P2RY12MAPTTP53HTR3AFBP1
SCHEMBL13635077 0.93 P2RY12 (0.64) P2RY12MAPTTP53HTR3ARXFP1
SCHEMBL13635618 0.93 P2RY12 (0.68) P2RY12MAPTTP53HTR3AFBP1
SCHEMBL13635164 0.91 P2RY12 (0.67) P2RY12MAPTTP53HTR3AFBP1
SCHEMBL13635048 0.91 P2RY12 (0.64) P2RY12MAPTTP53FBP1RXFP1
SCHEMBL13635261 0.91 P2RY12 (0.64) P2RY12MAPTTP53RXFP1SMN1; SMN2
SCHEMBL13635072 0.91 P2RY12 (0.64) P2RY12MAPTTP53FBP1RXFP1
SCHEMBL13635110 0.90 P2RY12 (0.66) P2RY12MAPTTP53HTR3AFBP1
SCHEMBL13634834 0.89 P2RY12 (0.62) P2RY12MAPTTP53FBP1RXFP1
SCHEMBL13635620 0.89 P2RY12 (0.62) P2RY12MAPTTP53FBP1RXFP1

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