SCHEMBL13635628

SCHEMBL13635628

O=C(NS(=O)(=O)C1CC=C(Cl)S1)c1ccc(-n2c(=O)[nH]c3cc(NCc4cc(F)cc(F)c4)ccc3c2=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HTR3A P46098 3/20 0.41
▸ TP53 P04637 4/20 0.40
▸ MAPT P10636 1/20 0.40
▸ P2RY12 Q9H244 1/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ GAA P10253 2/20 0.39
▸ RXFP1 Q9HBX9 4/20 0.38
▸ LMNA P02545 4/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ MEN1 O00255 2/20 0.37
▸ ALDH1A1 P00352 4/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ GLA P06280 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ USP2 O75604 1/20 0.33
▸ L3MBTL1 Q9Y468 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
SCHEMBL4418832 0.77 P2RY12 (0.54) HTR3ATP53MAPTP2RY12KMT2A
SCHEMBL13635070 0.77 P2RY12 (0.52) HTR3ATP53MAPTP2RY12KMT2A
SCHEMBL13635281 0.75 P2RY12 (0.68) HTR3ATP53MAPTP2RY12KMT2A
SCHEMBL13634875 0.74 P2RY12 (0.49) HTR3ATP53MAPTP2RY12KMT2A
SCHEMBL14273477 0.74 HTR3A (0.42) HTR3ATP53MAPTP2RY12KMT2A
SCHEMBL4415315 0.73 P2RY12 (0.52) TP53MAPTP2RY12KMT2AGAA
SCHEMBL1639624 0.73 RXFP1 (0.50) HTR3ATP53MAPTP2RY12KMT2A
SCHEMBL13634873 0.72 P2RY12 (0.52) TP53MAPTP2RY12KMT2AGAA
SCHEMBL13635102 0.72 P2RY12 (0.51) HTR3ATP53MAPTP2RY12KMT2A
SCHEMBL13635100 0.72 P2RY12 (0.54) HTR3ATP53MAPTP2RY12KMT2A

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
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