SCHEMBL13629226

SCHEMBL13629226

Nc1cc2c(O)c(N=Nc3ccc(N=Nc4ccc5c(c4)C(=O)NC5=O)c4ccc(O)cc34)c(S(=O)(=O)O)cc2cc1S(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 3/20 0.43
CD40 P25942 1/20 0.43
CD40LG P29965 1/20 0.43
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
THRB P10828 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ENPP2 Q13822 5/20 0.39
SENP3 Q9H4L4 3/20 0.39
SENP2 Q9HC62 3/20 0.39
SENP1 Q9P0U3 3/20 0.39
SUMO2 P61956 2/20 0.39
SUMO1 P63165 2/20 0.39
SENP7 Q9BQF6 2/20 0.39
CA2 P00918 1/20 0.39
CA3 P07451 1/20 0.39
PHLPP2 Q6ZVD8 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
SCHEMBL13629755 0.92 SENP3 (0.48) CD40CD40LGCYP2C9CYP2C19HSD17B10
SCHEMBL13629752 0.92 SENP3 (0.48) CD40CD40LGCYP2C9CYP2C19HSD17B10
SCHEMBL13615310 0.88 GLO1 (0.39) GLO1CD40CD40LGCYP2C9CYP2C19
SCHEMBL13629221 0.88 ENPP2 (0.51) CD40CD40LGCYP2C9CYP2C19HSD17B10
SCHEMBL13629223 0.85 ENPP2 (0.51) CD40CD40LGHSD17B10MEN1KMT2A
SCHEMBL13629247 0.84 ATIC (0.55) GLO1CD40CD40LGCYP2C9CYP2C19
SCHEMBL13629243 0.84 ATIC (0.55) GLO1CD40CD40LGCYP2C9CYP2C19
SCHEMBL13921666 0.84 SENP3 (0.45) CD40CD40LGCYP2C9CYP2C19HSD17B10
SCHEMBL13629434 0.81 MEN1 (0.49) CD40CD40LGCYP2C9CYP2C19HSD17B10
SCHEMBL13615315 0.81 SENP3 (0.42) CD40CD40LGCYP2C9CYP2C19HSD17B10

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 1 patent. 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