SCHEMBL13634932

SCHEMBL13634932

O=C(Nc1ccc(-n2c(=O)[nH]c3cc(NCc4ccccc4Cl)ccc3c2=O)cc1)NS(=O)(=O)c1ccc(Cl)s1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 1/20 0.63
TP53 P04637 4/20 0.45
MAPT P10636 5/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
RXFP1 Q9HBX9 2/20 0.36
HSP90AA1 P07900 1/20 0.36
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
MEN1 O00255 5/20 0.35
KMT2A Q03164 5/20 0.35
LMNA P02545 3/20 0.35
HTT P42858 2/20 0.35
RECQL P46063 2/20 0.35
FBP1 P09467 1/20 0.35
GAA P10253 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HTR3A P46098 1/20 0.34
POLB P06746 1/20 0.33
MCOLN3 Q8TDD5 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
SCHEMBL13635047 0.93 P2RY12 (0.67) P2RY12TP53MAPTSMN1; SMN2RXFP1
SCHEMBL13634810 0.93 P2RY12 (0.62) P2RY12TP53MAPTSMN1; SMN2RXFP1
SCHEMBL13635049 0.93 P2RY12 (0.60) P2RY12TP53MAPTSMN1; SMN2RXFP1
SCHEMBL13635261 0.92 P2RY12 (0.64) P2RY12TP53MAPTSMN1; SMN2RXFP1
SCHEMBL13635053 0.91 P2RY12 (0.58) P2RY12TP53MAPTSMN1; SMN2RXFP1
SCHEMBL13635110 0.91 P2RY12 (0.66) P2RY12TP53MAPTSMN1; SMN2RXFP1
SCHEMBL13635091 0.90 P2RY12 (0.65) P2RY12TP53MAPTSMN1; SMN2RXFP1
SCHEMBL13635084 0.90 P2RY12 (0.66) P2RY12TP53MAPTSMN1; SMN2RXFP1
SCHEMBL13635082 0.90 P2RY12 (0.58) P2RY12TP53MAPTSMN1; SMN2RXFP1
SCHEMBL13634834 0.89 P2RY12 (0.62) P2RY12TP53MAPTSMN1; SMN2RXFP1

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