SCHEMBL11118260

SCHEMBL11118260

CS(=O)(=O)c1cc(Nc2cccc(O)c2)c2c(c1N)C(=O)c1ccccc1C2=O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GNG2 P59768 4/20 0.65
▸ GNB1 P62873 4/20 0.65
▸ P2RY4 P51582 15/20 0.62
▸ P2RY2 P41231 10/20 0.61
▸ P2RY12 Q9H244 10/20 0.61
▸ P2RY6 Q15077 6/20 0.61
▸ ENTPD1 P49961 2/20 0.61
▸ ALDH1A1 P00352 1/20 0.61
▸ CYP1A2 P05177 1/20 0.61
▸ CYP3A4 P08684 1/20 0.61
▸ CYP2C9 P11712 1/20 0.61
▸ HPGD P15428 1/20 0.61
▸ ALOX15 P16050 1/20 0.61
▸ MAPK1 P28482 1/20 0.61
▸ CYP2C19 P33261 1/20 0.61
▸ HIF1A Q16665 1/20 0.61
▸ PHLPP2 Q6ZVD8 1/20 0.61
▸ HSD17B10 Q99714 1/20 0.61
▸ P2RY1 P47900 3/20 0.60
▸ CDK2 P24941 2/20 0.60

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
SCHEMBL15371424 0.89 GNG2 (0.80) GNG2GNB1P2RY4P2RY2P2RY12
SCHEMBL792757 0.88 GNG2 (0.79) GNG2GNB1P2RY4P2RY2P2RY12
SCHEMBL792756 0.87 P2RY4 (0.79) P2RY4P2RY2P2RY12P2RY6ENTPD1
SCHEMBL11116594 0.82 GNG2 (0.56) GNG2GNB1P2RY4P2RY2P2RY12
SCHEMBL9999815 0.79 GNG2 (0.79) GNG2GNB1P2RY4P2RY2P2RY12
SCHEMBL2778373 0.79 GNG2 (1.00) GNG2GNB1P2RY4P2RY2P2RY12
SCHEMBL790819 0.78 GNG2 (0.77) GNG2GNB1P2RY4P2RY2P2RY12
SCHEMBL8696533 0.78 P2RY4 (0.76) GNG2GNB1P2RY4P2RY2P2RY12
SCHEMBL29357302 0.78 GNG2 (0.85) GNG2GNB1P2RY4P2RY2P2RY12
SCHEMBL791019 0.78 GNG2 (0.85) GNG2GNB1P2RY4P2RY2P2RY12

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
US-4436906-A Anthraquinone dyes for cellulose-containing fibers and process for producing the same MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1984-03-13 — — US disclosed
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