SCHEMBL13615219

SCHEMBL13615219

NC(=O)c1ccc(N=Nc2ccc(N=Nc3c(SOOO)cc4cc(S(=O)(=O)O)c(N)cc4c3O)c3cc(S(=O)(=O)O)ccc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 9/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 1/20 0.43
THRB P10828 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SENP3 Q9H4L4 3/20 0.42
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
CD40 P25942 1/20 0.42
CD40LG P29965 1/20 0.42
PHLPP2 Q6ZVD8 1/20 0.41
ALDH1A1 P00352 2/20 0.39
HIF1A Q16665 2/20 0.39
CYP1A2 P05177 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
SCHEMBL13615218 0.93 MEN1 (0.42) ENPP2CYP2C9CYP2C19HSD17B10MEN1
SCHEMBL13597670 0.92 ENPP2 (0.45) ENPP2CYP2C9CYP2C19HSD17B10MEN1
SCHEMBL13615263 0.92 ALDH1A1 (0.46) ENPP2CYP2C9CYP2C19HSD17B10MEN1
SCHEMBL13615269 0.92 ALDH1A1 (0.42) ENPP2CYP2C9CYP2C19HSD17B10MEN1
SCHEMBL13010288 0.91 ALDH1A1 (0.47) ENPP2CYP2C9CYP2C19HSD17B10MEN1
SCHEMBL13615246 0.91 CYP2C9 (0.47) ENPP2CYP2C9CYP2C19HSD17B10MEN1
SCHEMBL13615266 0.91 MEN1 (0.41) ENPP2CYP2C9CYP2C19HSD17B10MEN1
SCHEMBL4401276 0.90 ENPP2 (0.44) ENPP2CYP2C9CYP2C19HSD17B10MEN1
SCHEMBL13615252 0.90 ENPP2 (0.44) ENPP2CYP2C9CYP2C19HSD17B10MEN1
SCHEMBL13615238 0.90 ENPP2 (0.44) ENPP2CYP2C9CYP2C19HSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275742-A1 COLORING MATTER FOR ANISOTROPIC COLORING MATTER FILM, COMPOSITION COMPRISING SAID COLORING MATTER, ANISOTROPIC COLORING MATTER FILM, AND POLARIZING ELEMENT MITSUBISHI CHEMICAL CORPORATION (JP) 2009-11-05 US disclosed
US-20090166583-A1 COMPOSITION FOR ANISOTROPIC PIGMENTED FILM, ANISOTROPIC PIGMENTED FILM, AND POLARIZING ELEMENT MITSUBISHI CHEMICAL CORPORATION (JP) 2009-07-02 US disclosed
US-20090040609-A1 COMPOSITION FOR ANISOTROPIC DYE FILM, ANISOTROPIC DYE FILM, AND POLARIZING DEVICE MITSUBISHI CHEMICAL CORPORATION (JP) 2009-02-12 US disclosed