SCHEMBL19628867

SCHEMBL19628867

Cc1cc(/N=N/c2cc(S(=O)(=O)O)c3cc(S(=O)(=O)O)c(/N=N/c4ccc([N+](=O)[O-])cc4)c(O)c3c2N)ccc1/N=N/c1ccc(OC=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 7/20 0.45
SENP2 Q9HC62 3/20 0.42
SENP1 Q9P0U3 3/20 0.42
SUMO2 P61956 2/20 0.42
SUMO1 P63165 2/20 0.42
SENP7 Q9BQF6 2/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HPGD P15428 3/20 0.41
ALDH1A1 P00352 3/20 0.41
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 2/20 0.41
CYP2C9 P11712 2/20 0.41
ALOX15 P16050 2/20 0.41
TSHR P16473 2/20 0.41
CYP2C19 P33261 2/20 0.41
HSD17B10 Q99714 2/20 0.41
APP P05067 2/20 0.41
MAPT P10636 2/20 0.41
THRB P10828 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
SCHEMBL19628863 0.84 CYP1A2 (0.48) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL17778347 0.84 ENPP2 (0.46) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL19628865 0.83 ENPP2 (0.40) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL15281272 0.82 SENP2 (0.55) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL19628869 0.81 ENPP2 (0.39) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL19628857 0.80 SENP2 (0.48) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL16062712 0.79 HPGD (0.48) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL19628862 0.79 CYP1A2 (0.60) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL16488665 0.77 CYP1A2 (0.42) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL19628864 0.77 ENPP2 (0.39) ENPP2SENP2SENP1SUMO2SUMO1

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-20170335110-A1 Black Trisazo Dyes, Their Preparation And Their Use LANXESS DEUTSCHLAND GMBH (DE) 2017-11-23 US disclosed