SCHEMBL13634811

SCHEMBL13634811

Cc1cc(CNc2ccc3c(=O)n(-c4ccc(NC(=O)NS(=O)(=O)c5ccc(Cl)s5)cc4)c(=O)[nH]c3c2)ccc1F

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.66
MAPT P10636 4/20 0.36
TP53 P04637 2/20 0.36
RXFP1 Q9HBX9 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
RECQL P46063 2/20 0.33
HSP90AA1 P07900 1/20 0.33
GAA P10253 1/20 0.33
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
FBP1 P09467 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HTR3A P46098 1/20 0.32

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
SCHEMBL13635083 0.94 P2RY12 (0.66) P2RY12MAPTTP53RXFP1SMN1; SMN2
SCHEMBL13635164 0.94 P2RY12 (0.67) P2RY12MAPTTP53RXFP1SMN1; SMN2
SCHEMBL13635262 0.91 P2RY12 (0.64) P2RY12MAPTTP53RXFP1SMN1; SMN2
SCHEMBL13635114 0.91 P2RY12 (0.66) P2RY12MAPTTP53RXFP1SMN1; SMN2
SCHEMBL13635072 0.91 P2RY12 (0.64) P2RY12MAPTTP53RXFP1SMN1; SMN2
SCHEMBL13635618 0.90 P2RY12 (0.68) P2RY12MAPTTP53RXFP1SMN1; SMN2
SCHEMBL13634834 0.89 P2RY12 (0.62) P2RY12MAPTTP53RXFP1SMN1; SMN2
SCHEMBL13635281 0.89 P2RY12 (0.68) P2RY12MAPTTP53RXFP1SMN1; SMN2
SCHEMBL13635048 0.89 P2RY12 (0.64) P2RY12MAPTTP53RXFP1SMN1; SMN2
SCHEMBL13635117 0.89 P2RY12 (0.62) P2RY12MAPTTP53RXFP1SMN1; SMN2

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