SCHEMBL9612299

SCHEMBL9612299

Cc1cc(N=Nc2ccc(N=Nc3ccc(N)cc3N)c3ccc(S(=O)(=O)O)cc23)ccc1N=Nc1ccc(C(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHLPP2 Q6ZVD8 5/20 0.52
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
HSD17B10 Q99714 1/20 0.50
SENP2 Q9HC62 7/20 0.48
SENP3 Q9H4L4 6/20 0.48
SENP1 Q9P0U3 6/20 0.48
SUMO2 P61956 4/20 0.48
SUMO1 P63165 4/20 0.48
SENP7 Q9BQF6 4/20 0.48
ENPP2 Q13822 2/20 0.44
ATIC P31939 1/20 0.42
SLC7A11 Q9UPY5 1/20 0.41
GLO1 Q04760 2/20 0.40
ALDH1A1 P00352 2/20 0.39
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL9612284 0.94 PHLPP2 (0.53) PHLPP2CYP2C9CYP2C19HSD17B10SENP2
SCHEMBL9612298 0.92 PHLPP2 (0.57) PHLPP2CYP2C9CYP2C19HSD17B10SENP2
SCHEMBL15316253 0.91 PHLPP2 (0.54) PHLPP2CYP2C9CYP2C19HSD17B10SENP2
SCHEMBL9612280 0.87 CYP2C9 (0.57) PHLPP2CYP2C9CYP2C19HSD17B10SENP2
SCHEMBL9612278 0.86 PHLPP2 (0.58) PHLPP2CYP2C9CYP2C19HSD17B10SENP2
SCHEMBL9612312 0.85 ENPP2 (0.53) PHLPP2CYP2C9CYP2C19HSD17B10SENP2
SCHEMBL15316252 0.85 PHLPP2 (0.55) PHLPP2CYP2C9CYP2C19HSD17B10SENP2
SCHEMBL15316259 0.84 PHLPP2 (0.49) PHLPP2CYP2C9CYP2C19HSD17B10SENP2
SCHEMBL9612296 0.83 CYP2C9 (0.51) PHLPP2CYP2C9CYP2C19HSD17B10SENP2
SCHEMBL27149864 0.83 CYP2C9 (0.69) PHLPP2CYP2C9CYP2C19HSD17B10SENP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2457955-B1 Trisazo dyes for paper dyeing KEMIRA OYJ (FI) 2017-08-09 EP disclosed
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
EP-2457955-A1 Trisazo dyes for paper dyeing Kemira Oyj (FI) 2012-05-30 EP disclosed