SCHEMBL13615204

SCHEMBL13615204

CNc1ccc2cc(SOOO)c(N=Nc3cc(C)c(N=Nc4ccc5c(S(=O)(=O)O)cccc5c4S(=O)(=O)O)cc3OC)c(O)c2c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 8/20 0.44
▸ PHLPP2 Q6ZVD8 1/20 0.39
▸ PTPN1 P18031 2/20 0.38
▸ ATIC P31939 2/20 0.34
▸ SUMO2 P61956 1/20 0.34
▸ SUMO1 P63165 1/20 0.34
▸ SENP7 Q9BQF6 1/20 0.34
▸ SENP2 Q9HC62 1/20 0.34
▸ MPL P40238 2/20 0.34
▸ PTPN11 Q06124 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ CTRC Q99895 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HIF1A Q16665 1/20 0.32

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
SCHEMBL13629302 0.89 ENPP2 (0.54) ENPP2PHLPP2PTPN1MPLMEN1
SCHEMBL12568502 0.84 ENPP2 (0.36) ENPP2PHLPP2PTPN1ATICSUMO2
SCHEMBL8929061 0.82 PHLPP2 (0.48) ENPP2PHLPP2PTPN1ATICSUMO2
SCHEMBL13860805 0.82 ENPP2 (0.44) ENPP2PHLPP2PTPN1MPLPTPN11
SCHEMBL13860883 0.81 ENPP2 (0.37) ENPP2PTPN1PTPN11MEN1KMT2A
SCHEMBL14523615 0.80 ENPP2 (0.58) ENPP2PHLPP2PTPN1ATICSUMO2
SCHEMBL14355349 0.80 ALDH1A1 (0.42) ENPP2PHLPP2ATICSUMO2SUMO1
SCHEMBL10392594 0.78 ENPP2 (0.47) ENPP2PHLPP2ATICMPLCYP1A2
SCHEMBL13841586 0.78 PHLPP2 (0.44) ENPP2PHLPP2PTPN1ATICSUMO2
SCHEMBL14645033 0.77 PHLPP2 (0.64) ENPP2PHLPP2PTPN1ATICSUMO2

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
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