SCHEMBL16557867

SCHEMBL16557867

Nc1c(N=Nc2ccc(Nc3nc(F)nc(Nc4ccccc4)n3)cc2)c(S(=O)(=O)O)cc2cccc(O)c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 7/20 0.45
▸ FUT8 Q9BYC5 1/20 0.43
▸ PHLPP2 Q6ZVD8 3/20 0.40
▸ PRMT3 O60678 1/20 0.40
▸ EP300 Q09472 1/20 0.40
▸ PRMT6 Q96LA8 1/20 0.40
▸ PRMT1 Q99873 1/20 0.40
▸ TTR P02766 1/20 0.38
▸ FABP4 P15090 1/20 0.38
▸ CCNA2 P20248 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ NR4A1 P22736 1/20 0.38
▸ CYP1A2 P05177 3/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA4 P22748 1/20 0.37
▸ CA6 P23280 1/20 0.37
▸ CA7 P43166 1/20 0.37

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
SCHEMBL17928436 0.95 ENPP2 (0.43) ENPP2FUT8PHLPP2PRMT3EP300
SCHEMBL16557840 0.93 FUT8 (0.43) ENPP2FUT8PHLPP2PRMT1CYP1A2
SCHEMBL16557837 0.91 FUT8 (0.53) ENPP2FUT8PHLPP2PRMT3EP300
SCHEMBL16557866 0.86 THRB (0.50) ENPP2FUT8PHLPP2PRMT3EP300
SCHEMBL16557843 0.86 THRB (0.45) ENPP2FUT8PHLPP2PRMT1CA12
SCHEMBL16557864 0.84 FUT8 (0.52) ENPP2FUT8PHLPP2PRMT1CYP1A2
SCHEMBL16557868 0.83 SENP2 (0.49) ENPP2FUT8TTRFABP4CCNA2
SCHEMBL16557831 0.82 ENPP2 (0.57) ENPP2PHLPP2PRMT3EP300PRMT6
SCHEMBL16560654 0.80 FUT8 (0.53) ENPP2FUT8PHLPP2PRMT1CYP1A2
SCHEMBL16557865 0.79 ENPP2 (0.39) ENPP2FUT8PHLPP2PRMT3EP300

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9394445-B2 Method for continuously preparing water-soluble azo dye by coupling a nebulizer with a pipeline DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2016-07-19 — — US disclosed
US-20150073132-A1 METHOD FOR CONTINUOUSLY PREPARING WATER-SOLUBLE AZO DYE BY COUPLING A NEBULIZER WITH A PIPELINE DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2015-03-12 — — US disclosed
Send feedback