SCHEMBL13635264

SCHEMBL13635264

O=C(Nc1ccc(-n2c(=O)[nH]c3cc(NCc4cccs4)ccc3c2=O)cc1)NS(=O)(=O)c1ccc(Cl)s1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.61
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 4/20 0.35
TP53 P04637 2/20 0.35
NR1H4 Q96RI1 1/20 0.35
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
RECQL P46063 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
FBP1 P09467 1/20 0.34
RXFP1 Q9HBX9 2/20 0.33
FPR2 P25090 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL13635110 0.92 P2RY12 (0.66) P2RY12MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL13635167 0.90 P2RY12 (0.61) P2RY12MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL13635078 0.89 P2RY12 (0.65) P2RY12MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL13635267 0.89 P2RY12 (0.60) P2RY12RAB9ANPC1MAPTTP53
SCHEMBL13634949 0.89 P2RY12 (0.60) P2RY12MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL13635076 0.89 P2RY12 (0.64) P2RY12MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL13635261 0.89 P2RY12 (0.64) P2RY12MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL13634871 0.88 P2RY12 (0.62) P2RY12MEN1KMT2ASMN1; SMN2NPC1
SCHEMBL13635061 0.88 P2RY12 (0.61) P2RY12MAPTTP53FBP1RXFP1
SCHEMBL13634932 0.88 P2RY12 (0.63) P2RY12MEN1KMT2ASMN1; SMN2L3MBTL1

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