SCHEMBL13615142

SCHEMBL13615142

Cc1cc(N=Nc2c(SOOO)cc3ccc(NCCC(=O)O)cc3c2O)c(OCC(O)CO)cc1N=Nc1ccc(N=Nc2ccc3ccc(SOOO)cc3c2)c2ccc(S(=O)(=O)O)cc12

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 9/20 0.38
PTPN11 Q06124 1/20 0.34
CD40 P25942 1/20 0.31
CD40LG P29965 1/20 0.31

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
SCHEMBL13615312 0.84 PTPN11 (0.40) ENPP2PTPN11
SCHEMBL13615159 0.81 PTPN11 (0.41) ENPP2PTPN11
SCHEMBL13615133 0.81 PTPN11 (0.41) ENPP2PTPN11
SCHEMBL13615155 0.78 PTPN11 (0.38) ENPP2PTPN11CD40CD40LG
SCHEMBL13615157 0.77 ENPP2 (0.45) ENPP2PTPN11CD40CD40LG
SCHEMBL13860893 0.76 ENPP2 (0.39) ENPP2PTPN11
SCHEMBL13615214 0.75 ENPP2 (0.39) ENPP2PTPN11
SCHEMBL12568493 0.75 PTPN11 (0.38) ENPP2PTPN11
SCHEMBL12568510 0.74 ENPP2 (0.34) ENPP2
SCHEMBL13615268 0.74 CYP2C9 (0.39) ENPP2PTPN11CD40CD40LG

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