SCHEMBL13615169

SCHEMBL13615169

COc1cc(/N=N/c2ccc3c(SOOO)cccc3c2)ccc1/N=N/c1cc(C)c(/N=N/c2c(SOOO)cc3cc(S(=O)(=O)O)c(N)cc3c2O)cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 9/20 0.46
PHLPP2 Q6ZVD8 2/20 0.44
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
APEX1 P27695 1/20 0.37
MAPK1 P28482 1/20 0.37
BRCA1 P38398 1/20 0.37
RECQL P46063 1/20 0.37
BLM P54132 1/20 0.37
SLC10A1 Q14973 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL13286618 0.91 ENPP2 (0.43) ENPP2PHLPP2ALDH1A1MEN1KMT2A
SCHEMBL14029011 0.91 ENPP2 (0.43) ENPP2PHLPP2ALDH1A1MEN1KMT2A
SCHEMBL13615148 0.90 ENPP2 (0.46) ENPP2PHLPP2ALDH1A1MEN1KMT2A
SCHEMBL13860930 0.89 ENPP2 (0.45) ENPP2PHLPP2ALDH1A1MEN1KMT2A
SCHEMBL13860890 0.89 PHLPP2 (0.43) ENPP2PHLPP2ALDH1A1MEN1KMT2A
SCHEMBL13860927 0.88 PHLPP2 (0.45) ENPP2PHLPP2ALDH1A1MEN1KMT2A
SCHEMBL13615143 0.88 ENPP2 (0.48) ENPP2PHLPP2ALDH1A1MEN1KMT2A
SCHEMBL13860923 0.88 ENPP2 (0.43) ENPP2PHLPP2ALDH1A1MEN1KMT2A
SCHEMBL13860875 0.87 ENPP2 (0.45) ENPP2PHLPP2ALDH1A1MEN1KMT2A
SCHEMBL13615335 0.87 SENP2 (0.51) ENPP2PHLPP2ALDH1A1MEN1KMT2A

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