SCHEMBL3434065

SCHEMBL3434065

[C-]#[N+]c1cc(S(=O)(=O)O)ccc1N=Nc1ccc2ccc(N=Nc3ccc([N+](=O)[O-])cc3)c(O)c2c1N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 4/20 0.48
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
HSD17B10 Q99714 2/20 0.41
APEX1 P27695 1/20 0.40
CYP1A2 P05177 2/20 0.39
PHLPP2 Q6ZVD8 1/20 0.38
SENP2 Q9HC62 5/20 0.38
SUMO2 P61956 3/20 0.38
SUMO1 P63165 3/20 0.38
SENP7 Q9BQF6 3/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL3435585 0.88 ENPP2 (0.51) ENPP2MEN1MAPTKMT2ANPSR1
SCHEMBL3435549 0.85 SENP2 (0.51) ENPP2MEN1MAPTKMT2ANPSR1
SCHEMBL3434070 0.82 ALDH1A1 (0.56) ENPP2MEN1MAPTKMT2ANPSR1
SCHEMBL29702427 0.79 ENPP2 (0.55) ENPP2MEN1MAPTKMT2ANPSR1
SCHEMBL3434139 0.78 ENPP2 (0.68) ENPP2MEN1MAPTKMT2ANPSR1
SCHEMBL3435168 0.78 ENPP2 (0.49) ENPP2MEN1MAPTKMT2ACYP2C9
SCHEMBL31222686 0.78 MEN1 (0.51) ENPP2MEN1MAPTKMT2ANPSR1
SCHEMBL3435541 0.78 MEN1 (0.51) ENPP2MEN1MAPTKMT2ANPSR1
SCHEMBL3435182 0.78 ENPP2 (0.47) ENPP2MEN1MAPTKMT2ANPSR1
SCHEMBL3201797 0.77 MEN1 (0.50) ENPP2MEN1MAPTKMT2ANPSR1

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-8834620-B2 Black disazo dyes, their preparation and use ILFORD IMAGING SWITZERLAND GMBH (CH) 2014-09-16 US disclosed
US-20120090503-A1 BLACK DISAZO DYES, THEIR PREPARATION AND USE ILFORD IMAGING SWITZERLAND GMBH 2012-04-19 US disclosed