SCHEMBL16560655

SCHEMBL16560655

Nc1c(N=Nc2ccc(Nc3nc(F)nc(Nc4cccc(S(=O)(=O)O)c4)n3)cc2S(=O)(=O)O)c(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(O)c12

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.49
▸ ENPP2 Q13822 6/20 0.49
▸ CYP1A2 P05177 2/20 0.48
▸ PRMT1 Q99873 1/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ THRB P10828 1/20 0.46
▸ CYP2C9 P11712 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ DNASE1L3 Q13609 1/20 0.45
▸ CHAT P28329 2/20 0.41
▸ ENPP3 O14638 1/20 0.41
▸ ENPP1 P22413 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ CD40 P25942 1/20 0.38
▸ CD40LG P29965 1/20 0.38
▸ PHLPP2 Q6ZVD8 2/20 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
SCHEMBL16560654 0.95 FUT8 (0.53) FUT8ENPP2CYP1A2PRMT1MEN1
SCHEMBL17929009 0.94 ENPP2 (0.52) FUT8ENPP2CYP1A2PRMT1MEN1
SCHEMBL16560656 0.92 FUT8 (0.59) FUT8ENPP2CYP1A2PRMT1MEN1
SCHEMBL16560663 0.87 FUT8 (0.64) FUT8ENPP2CYP1A2PRMT1MEN1
SCHEMBL16560657 0.86 FUT8 (0.44) FUT8ENPP2CYP1A2PRMT1MEN1
SCHEMBL9343981 0.85 FUT8 (0.59) FUT8ENPP2CYP1A2PRMT1MEN1
SCHEMBL16557840 0.84 FUT8 (0.43) FUT8ENPP2CYP1A2PRMT1CYP2C9
SCHEMBL16560632 0.84 FUT8 (0.51) FUT8ENPP2CYP1A2PRMT1MEN1
SCHEMBL16560566 0.79 ENPP2 (0.49) FUT8ENPP2CYP1A2MEN1KMT2A
SCHEMBL14038348 0.79 FUT8 (0.57) FUT8ENPP2CYP1A2PRMT1MEN1

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
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