SCHEMBL13629220

SCHEMBL13629220

Nc1cc(S(=O)(=O)O)cc2cc(S(=O)(=O)O)c(/N=N\c3ccc(/N=N\c4ccc5c(S(=O)(=O)O)cccc5c4)c4ccc(S(=O)(=O)O)cc34)c(O)c12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHLPP2 Q6ZVD8 2/20 0.63
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
HTT P42858 1/20 0.61
CYP1A2 P05177 3/20 0.58
CYP2C9 P11712 2/20 0.58
MAPK1 P28482 1/20 0.58
DNASE1L3 Q13609 1/20 0.58
ENPP2 Q13822 6/20 0.56
ATIC P31939 1/20 0.52
THRB P10828 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
PRMT1 Q99873 1/20 0.50
ALDH1A1 P00352 1/20 0.50
HIF1A Q16665 1/20 0.50
SENP3 Q9H4L4 2/20 0.49
SENP2 Q9HC62 2/20 0.49
SENP1 Q9P0U3 2/20 0.49
SUMO2 P61956 1/20 0.49
SUMO1 P63165 1/20 0.49

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
SCHEMBL13629217 0.87 ATIC (0.54) PHLPP2MEN1KMT2ACYP1A2CYP2C9
SCHEMBL13615334 0.87 PHLPP2 (0.49) PHLPP2MEN1KMT2AHTTCYP1A2
SCHEMBL13629219 0.85 ATIC (0.54) PHLPP2MEN1KMT2ACYP1A2CYP2C9
SCHEMBL10448356 0.85 CYP1A2 (0.62) PHLPP2MEN1KMT2AHTTCYP1A2
SCHEMBL9174934 0.85 CYP1A2 (0.62) PHLPP2MEN1KMT2AHTTCYP1A2
SCHEMBL13936090 0.84 ATIC (0.52) PHLPP2MEN1KMT2ACYP1A2CYP2C9
SCHEMBL13936093 0.84 ATIC (0.54) PHLPP2MEN1KMT2ACYP1A2CYP2C9
SCHEMBL10448696 0.84 PHLPP2 (0.61) PHLPP2MEN1KMT2AHTTCYP1A2
SCHEMBL9179546 0.84 PHLPP2 (0.61) PHLPP2MEN1KMT2AHTTCYP1A2
SCHEMBL10448639 0.83 MEN1 (0.77) PHLPP2MEN1KMT2AHTTCYP1A2

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