SCHEMBL15316252

SCHEMBL15316252

Cc1cc(N=Nc2ccc(N=Nc3ccc(N)cc3)c3ccc(S(=O)(=O)O)cc23)ccc1N=Nc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHLPP2 Q6ZVD8 2/20 0.55
SENP2 Q9HC62 9/20 0.55
SENP1 Q9P0U3 8/20 0.55
SENP3 Q9H4L4 6/20 0.55
SUMO2 P61956 6/20 0.55
SUMO1 P63165 6/20 0.55
SENP7 Q9BQF6 6/20 0.55
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
HSD17B10 Q99714 1/20 0.54
POLB P06746 1/20 0.48
CYP2D6 P10635 1/20 0.48
ATIC P31939 1/20 0.47
CYP1A2 P05177 1/20 0.47
GLO1 Q04760 1/20 0.45
ENPP2 Q13822 2/20 0.44
SLC7A11 Q9UPY5 1/20 0.44
ALDH1A1 P00352 1/20 0.43
HIF1A Q16665 1/20 0.43
RPS6KA3 P51812 1/20 0.43

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
SCHEMBL9612278 0.94 PHLPP2 (0.58) PHLPP2SENP2SENP1SENP3SUMO2
SCHEMBL15316253 0.94 PHLPP2 (0.54) PHLPP2SENP2SENP1SENP3SUMO2
SCHEMBL10448647 0.93 SENP2 (0.55) PHLPP2SENP2SENP1SENP3SUMO2
SCHEMBL9175459 0.93 SENP2 (0.55) PHLPP2SENP2SENP1SENP3SUMO2
SCHEMBL16687355 0.91 PHLPP2 (0.52) PHLPP2SENP2SENP1SENP3SUMO2
SCHEMBL9612284 0.90 PHLPP2 (0.53) PHLPP2SENP2SENP1SENP3SUMO2
SCHEMBL15316262 0.90 CYP2C9 (0.60) PHLPP2SENP2SENP1SENP3SUMO2
SCHEMBL9612298 0.88 PHLPP2 (0.57) PHLPP2SENP2SENP1SENP3SUMO2
SCHEMBL15316257 0.86 CYP2C9 (0.53) PHLPP2SENP2SENP1SENP3SUMO2
SCHEMBL16687354 0.86 ALDH1A1 (0.51) PHLPP2SENP2SENP1SENP3SUMO2

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-9023118-B2 Azo dyes KEMIRA OYJ (FI) 2015-05-05 US disclosed
US-20130269124-A1 AZO DYES CHROMASCAPE, LLC 2013-10-17 US disclosed