SCHEMBL13615324

SCHEMBL13615324

Nc1cc2c(O)c(/N=N/c3ccc(/N=N/c4cnc5c(SOOO)cccc5c4)c4ccc(C(=O)O)nc34)c(SOOO)cc2cc1S(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 1/20 0.37
ENPP2 Q13822 5/20 0.33
CYP1A2 P05177 3/20 0.32
ALDH1A1 P00352 2/20 0.32
HIF1A Q16665 1/20 0.32
ATIC P31939 1/20 0.32
PHLPP2 Q6ZVD8 1/20 0.32
SENP2 Q9HC62 1/20 0.32
SENP1 Q9P0U3 1/20 0.32
CD40 P25942 1/20 0.31
CD40LG P29965 1/20 0.31
MEN1 O00255 1/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL13615328 0.89 PTPN11 (0.41) PTPN11ENPP2PHLPP2SENP2SENP1
SCHEMBL13615326 0.88 ALDH1A1 (0.40) PTPN11ENPP2CYP1A2ALDH1A1HIF1A
SCHEMBL13629446 0.87 ENPP2 (0.42) ENPP2CYP1A2ALDH1A1HIF1AATIC
SCHEMBL13921648 0.85 PTPN11 (0.38) PTPN11ENPP2CYP1A2ALDH1A1HIF1A
SCHEMBL13921645 0.85 PTPN11 (0.38) PTPN11ENPP2CYP1A2ALDH1A1HIF1A
SCHEMBL13615110 0.83 PTPN11 (0.51) PTPN11ENPP2CYP1A2ALDH1A1HIF1A
SCHEMBL13921626 0.81 PTPN11 (0.33) PTPN11
SCHEMBL13615112 0.80 PTPN11 (0.49) PTPN11ENPP2CYP1A2HIF1APHLPP2
SCHEMBL13615147 0.79 ATIC (0.51) PTPN11ENPP2CYP1A2ALDH1A1HIF1A
SCHEMBL13615291 0.79 MEN1 (0.42) PTPN11ENPP2CYP1A2ALDH1A1HIF1A

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