SCHEMBL13860889

SCHEMBL13860889

COc1cc(N=Nc2cccc(SOOO)c2)ccc1N=Nc1ccc(N=Nc2c(SOOO)cc3ccc(Nc4cccc(S(=O)(=O)O)c4)cc3c2O)cc1C

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 11/20 0.45
▸ PTPN11 Q06124 1/20 0.38
▸ PHLPP2 Q6ZVD8 3/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ CD40 P25942 1/20 0.33
▸ CD40LG P29965 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33

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
SCHEMBL13991866 0.93 ENPP2 (0.46) ENPP2PTPN11PHLPP2ALDH1A1HIF1A
SCHEMBL14565778 0.90 ENPP2 (0.38) ENPP2PTPN11PHLPP2GAAMAPT
SCHEMBL13860859 0.84 ENPP2 (0.45) ENPP2PTPN11PHLPP2CD40CD40LG
SCHEMBL12925203 0.84 ENPP2 (0.57) ENPP2PHLPP2ALDH1A1HIF1AGAA
SCHEMBL13860890 0.84 PHLPP2 (0.43) ENPP2PTPN11PHLPP2ALDH1A1HIF1A
SCHEMBL13860883 0.83 ENPP2 (0.37) ENPP2PTPN11ALDH1A1MAPTMAPK1
SCHEMBL13679648 0.82 ENPP2 (0.51) ENPP2PTPN11PHLPP2ALDH1A1HIF1A
SCHEMBL13860869 0.82 ENPP2 (0.47) ENPP2PTPN11PHLPP2ALDH1A1HIF1A
SCHEMBL13993036 0.82 ENPP2 (0.47) ENPP2PTPN11PHLPP2ALDH1A1HIF1A
SCHEMBL13286618 0.81 ENPP2 (0.43) ENPP2PTPN11PHLPP2ALDH1A1HIF1A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7527862-B2 Dyes for anisotropic dye films, dye compositions for anisotropic dye films, anisotropic dye films and polarizing elements MITSUBISHI CHEMICAL CORPORATION (JP) 2009-05-05 — — US disclosed
US-20090027774-A1 COMPOSITION FOR ANISOTROPIC DYESTUFF FILM, ANISOTROPIC DYESTUFF FILM AND POLARIZING ELEMENT MITSUBISHI CHEMICAL CORPORATION (JP) 2009-01-29 — — US disclosed
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