SCHEMBL2585430

SCHEMBL2585430

Nc1ccc(N=Nc2ccc(S(=O)(=O)O)cc2)c2ccc(S(=O)(=O)O)cc12

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.81
CYP2C19 P33261 1/20 0.81
HSD17B10 Q99714 1/20 0.81
PHLPP2 Q6ZVD8 2/20 0.79
SENP2 Q9HC62 6/20 0.65
SENP3 Q9H4L4 5/20 0.65
SENP1 Q9P0U3 5/20 0.65
SUMO2 P61956 4/20 0.65
SUMO1 P63165 4/20 0.65
SENP7 Q9BQF6 4/20 0.65
SLC7A11 Q9UPY5 1/20 0.60
GLO1 Q04760 5/20 0.52
ENPP2 Q13822 1/20 0.49
RPS6KA3 P51812 1/20 0.49
POLB P06746 1/20 0.49
CYP2D6 P10635 1/20 0.49
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL2585427 1.00 CYP2C9 (0.81) CYP2C9CYP2C19HSD17B10PHLPP2SENP2
SCHEMBL12177913 0.99 CYP2C9 (0.79) CYP2C9CYP2C19HSD17B10PHLPP2SENP2
SCHEMBL14413264 0.96 CYP2C9 (0.88) CYP2C9CYP2C19HSD17B10PHLPP2SENP2
SCHEMBL12177898 0.96 CYP2C9 (0.76) CYP2C9CYP2C19HSD17B10PHLPP2SENP2
SCHEMBL12177917 0.96 CYP2C9 (0.75) CYP2C9CYP2C19HSD17B10PHLPP2SENP2
SCHEMBL14418368 0.94 CYP2C9 (0.90) CYP2C9CYP2C19HSD17B10PHLPP2SENP2
SCHEMBL2592899 0.94 CYP2C9 (0.73) CYP2C9CYP2C19HSD17B10PHLPP2SENP2
SCHEMBL2592902 0.94 CYP2C9 (0.73) CYP2C9CYP2C19HSD17B10PHLPP2SENP2
SCHEMBL15276091 0.92 CYP2C9 (0.71) CYP2C9CYP2C19HSD17B10PHLPP2SENP2
SCHEMBL2587651 0.92 CYP2C9 (0.73) CYP2C9CYP2C19HSD17B10PHLPP2SENP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2566941-B1 DYES AND BLENDS FOR SHADING DURING LAUNDRY BASF SE (DE) 2016-12-21 EP disclosed
US-8585780-B2 Dyes and blends for shading during laundry BASF SE (DE) 2013-11-19 US disclosed
US-20130247309-A1 DYES AND BLENDS FOR SHADING DURING LAUNDRY BASF SE (DE) 2013-09-26 US disclosed
EP-2566941-A1 DYES AND BLENDS FOR SHADING DURING LAUNDRY BASF SE (DE) 2013-03-13 EP disclosed
WO-2011138183-A1 DYES AND BLENDS FOR SHADING DURING LAUNDRY BASF SE (DE) 2011-11-10 WO disclosed
US-5969115-A INK JET PRINTING OF CELLULOSE; BLACK DYES; LIGHTFASTNESS ILFORD IMAGING SWITZERLAND GMBH (CH) 1999-10-19 US disclosed
EP-0348050-A1 Colorant for printing IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1989-12-27 EP disclosed