SCHEMBL13635287

SCHEMBL13635287

CCCCCCNc1ccc2c(=O)n(-c3ccc(C(=O)NS(=O)(=O)c4ccc(Cl)s4)cc3)c(=O)[nH]c2c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.54
RXFP1 Q9HBX9 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
TP53 P04637 4/20 0.41
MAPT P10636 5/20 0.40
POLB P06746 1/20 0.40
GAA P10253 3/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
HTR3A P46098 3/20 0.38

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
SCHEMBL13635177 0.94 P2RY12 (0.57) P2RY12RXFP1SMN1; SMN2KMT2AMEN1
SCHEMBL13635099 0.89 P2RY12 (0.52) P2RY12RXFP1SMN1; SMN2KMT2AMEN1
SCHEMBL13635630 0.89 P2RY12 (0.55) P2RY12RXFP1SMN1; SMN2KMT2AMEN1
SCHEMBL13635179 0.87 P2RY12 (0.54) P2RY12RXFP1SMN1; SMN2KMT2AMEN1
SCHEMBL13635285 0.86 P2RY12 (0.63) P2RY12RXFP1SMN1; SMN2KMT2AMEN1
SCHEMBL13635629 0.86 P2RY12 (0.52) P2RY12RXFP1SMN1; SMN2KMT2AMEN1
SCHEMBL4418832 0.85 P2RY12 (0.54) P2RY12RXFP1SMN1; SMN2KMT2AMEN1
SCHEMBL13634873 0.85 P2RY12 (0.52) P2RY12RXFP1SMN1; SMN2KMT2AMEN1
SCHEMBL4415315 0.85 P2RY12 (0.52) P2RY12RXFP1SMN1; SMN2KMT2AMEN1
SCHEMBL9922499 0.84 P2RY12 (0.70) P2RY12RXFP1SMN1; SMN2KMT2AMEN1

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