SCHEMBL13615214

SCHEMBL13615214

Cc1cc(N=Nc2c(SOOO)cc3cc(S(=O)(=O)O)c(N)cc3c2O)c(OCC(O)CO)cc1N=Nc1ccc2cc(SOOO)cc(S(=O)(=O)O)c2c1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 6/20 0.39
PTPN11 Q06124 1/20 0.38
PHLPP2 Q6ZVD8 1/20 0.31
SUMO2 P61956 2/20 0.31
SUMO1 P63165 2/20 0.31
SENP7 Q9BQF6 2/20 0.31
SENP2 Q9HC62 2/20 0.31
SENP3 Q9H4L4 1/20 0.31
SENP1 Q9P0U3 1/20 0.31
ATIC P31939 1/20 0.30
MEN1 O00255 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL13615159 0.94 PTPN11 (0.41) ENPP2PTPN11SUMO2SUMO1SENP7
SCHEMBL13615133 0.94 PTPN11 (0.41) ENPP2PTPN11SUMO2SUMO1SENP7
SCHEMBL12568493 0.92 PTPN11 (0.38) ENPP2PTPN11PHLPP2SUMO2SUMO1
SCHEMBL13921664 0.92 ENPP2 (0.38) ENPP2PTPN11PHLPP2SUMO2SUMO1
SCHEMBL13921670 0.90 ENPP2 (0.38) ENPP2PTPN11PHLPP2SUMO2SUMO1
SCHEMBL12568526 0.89 ENPP2 (0.38) ENPP2PTPN11PHLPP2SUMO2SUMO1
SCHEMBL12568496 0.89 PHLPP2 (0.41) ENPP2PTPN11PHLPP2
SCHEMBL12568508 0.88 PTPN11 (0.40) ENPP2PTPN11PHLPP2SENP2SENP1
SCHEMBL12568506 0.88 ENPP2 (0.37) ENPP2PTPN11PHLPP2SUMO2SUMO1
SCHEMBL12568517 0.88 ENPP2 (0.36) ENPP2PTPN11

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