SCHEMBL13635102

SCHEMBL13635102

O=C(NS(=O)(=O)c1ccc(Cl)s1)c1ccc(-n2c(=O)[nH]c3cc(NCc4ccncc4)ccc3c2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.51
TP53 P04637 4/20 0.42
MAPT P10636 2/20 0.42
RXFP1 Q9HBX9 3/20 0.40
LMNA P02545 2/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.36
HTR3A P46098 3/20 0.35
HDAC1 Q13547 1/20 0.35
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.33
NR1H4 Q96RI1 1/20 0.33

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
SCHEMBL4415315 0.92 P2RY12 (0.52) P2RY12TP53MAPTRXFP1LMNA
SCHEMBL13635050 0.91 P2RY12 (0.48) P2RY12TP53MAPTRXFP1LMNA
SCHEMBL13634873 0.91 P2RY12 (0.52) P2RY12TP53MAPTRXFP1LMNA
SCHEMBL4418832 0.91 P2RY12 (0.54) P2RY12TP53MAPTRXFP1LMNA
SCHEMBL13635098 0.89 MEN1 (0.53) P2RY12TP53MAPTRXFP1KMT2A
SCHEMBL13635284 0.87 P2RY12 (0.49) P2RY12TP53MAPTRXFP1KMT2A
SCHEMBL13635070 0.87 P2RY12 (0.52) P2RY12TP53MAPTRXFP1LMNA
SCHEMBL13635177 0.86 P2RY12 (0.57) P2RY12TP53MAPTRXFP1KMT2A
SCHEMBL13635174 0.86 P2RY12 (0.49) P2RY12TP53MAPTRXFP1LMNA
SCHEMBL13635179 0.85 P2RY12 (0.54) P2RY12TP53MAPTRXFP1LMNA

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