SCHEMBL416366

SCHEMBL416366

Cc1ccc(N=Nc2ccc(N=Nc3ccc4cc(S(=O)(=O)O)c(N)cc4c3O)c3cc(S(=O)(=O)O)ccc23)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.55
CYP2C19 P33261 1/20 0.55
HSD17B10 Q99714 1/20 0.55
CYP1A2 P05177 2/20 0.54
PHLPP2 Q6ZVD8 1/20 0.54
SENP2 Q9HC62 6/20 0.53
SENP3 Q9H4L4 5/20 0.53
SENP1 Q9P0U3 5/20 0.53
SUMO2 P61956 4/20 0.53
SUMO1 P63165 4/20 0.53
SENP7 Q9BQF6 4/20 0.53
ALDH1A1 P00352 1/20 0.50
HIF1A Q16665 1/20 0.50
ENPP2 Q13822 4/20 0.48
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
THRB P10828 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL15127525 0.91 ALDH1A1 (0.55) CYP2C9CYP2C19HSD17B10CYP1A2PHLPP2
SCHEMBL11926249 0.91 CYP2C9 (0.56) CYP2C9CYP2C19HSD17B10CYP1A2PHLPP2
SCHEMBL416360 0.89 CYP2C9 (0.53) CYP2C9CYP2C19HSD17B10CYP1A2PHLPP2
SCHEMBL414245 0.87 CYP2C9 (0.55) CYP2C9CYP2C19HSD17B10CYP1A2PHLPP2
SCHEMBL9332175 0.84 CD40 (0.57) CYP2C9CYP2C19HSD17B10CYP1A2PHLPP2
SCHEMBL29635262 0.84 CD40 (0.57) CYP2C9CYP2C19HSD17B10CYP1A2PHLPP2
SCHEMBL5177418 0.84 CD40 (0.57) CYP2C9CYP2C19HSD17B10CYP1A2PHLPP2
SCHEMBL9332169 0.84 CD40 (0.57) CYP2C9CYP2C19HSD17B10CYP1A2PHLPP2
SCHEMBL8946989 0.84 CD40 (0.57) CYP2C9CYP2C19HSD17B10CYP1A2PHLPP2
SCHEMBL28389935 0.84 CD40 (0.56) CYP2C9CYP2C19HSD17B10CYP1A2PHLPP2

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
US-8741190-B2 Process for producing water-resistant polarizing film NITTO DENKO CORPORATION (JP) 2014-06-03 US disclosed
US-8734677-B2 Liquid-crystal coating fluid and polarizing film NITTO DENKO CORPORATION (JP) 2014-05-27 US disclosed
US-20130277871-A1 PROCESS FOR PRODUCING WATER-RESISTANT POLARIZING FILM NITTO DENKO CORPRATION (JP) 2013-10-24 US disclosed
US-20120062829-A1 LIQUID-CRYSTAL COATING FLUID AND POLARIZING FILM NITTO DENKO CORPORATION (JP) 2012-03-15 US disclosed