SCHEMBL20735481

SCHEMBL20735481

Nc1ccc(N=Nc2ccc(N=Nc3ccc(S(=O)(=O)O)cc3S(=O)(=O)O)c3ccc(S(=O)(=O)O)cc23)c2ccc(S(=O)(=O)O)cc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.64
CYP2C19 P33261 2/20 0.64
HSD17B10 Q99714 2/20 0.64
SENP2 Q9HC62 7/20 0.63
SENP3 Q9H4L4 6/20 0.63
SENP1 Q9P0U3 6/20 0.63
SUMO2 P61956 5/20 0.63
SUMO1 P63165 5/20 0.63
SENP7 Q9BQF6 5/20 0.63
PHLPP2 Q6ZVD8 1/20 0.62
SLC7A11 Q9UPY5 1/20 0.49
ENPP2 Q13822 2/20 0.48
ALDH1A1 P00352 2/20 0.47
CASP6 P55212 1/20 0.47
MEN1 O00255 1/20 0.46
THRB P10828 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
GLO1 Q04760 4/20 0.45
CYP1A2 P05177 2/20 0.41

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
SCHEMBL20735468 0.99 HSD17B10 (0.65) CYP2C9CYP2C19HSD17B10SENP2SENP3
SCHEMBL11402526 0.99 HSD17B10 (0.65) CYP2C9CYP2C19HSD17B10SENP2SENP3
SCHEMBL12177951 0.92 CYP2C9 (0.61) CYP2C9CYP2C19HSD17B10SENP2SENP3
SCHEMBL12177950 0.89 SENP2 (0.64) CYP2C9CYP2C19HSD17B10SENP2SENP3
SCHEMBL2589319 0.89 HSD17B10 (0.64) CYP2C9CYP2C19HSD17B10SENP2SENP3
SCHEMBL2589316 0.89 HSD17B10 (0.64) CYP2C9CYP2C19HSD17B10SENP2SENP3
SCHEMBL15276091 0.89 CYP2C9 (0.71) CYP2C9CYP2C19HSD17B10SENP2SENP3
SCHEMBL20736023 0.88 SENP2 (0.62) CYP2C9CYP2C19HSD17B10SENP2SENP3
SCHEMBL4254801 0.87 CYP2C9 (0.57) CYP2C9CYP2C19HSD17B10SENP2SENP3
SCHEMBL4254803 0.87 CYP2C9 (0.57) CYP2C9CYP2C19HSD17B10SENP2SENP3

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-20190048194-A1 Azo Compound Or Salt Thereof, And Polarizing Film Containing Same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2019-02-14 US disclosed