SCHEMBL14469790

SCHEMBL14469790

COc1cc(/N=N\c2cc(NC(C)=O)c(/N=N\c3ccc(S(=O)(=O)O)cc3C(=O)O)cc2OC)c(C)cc1N

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 7/20 0.45
▸ PHLPP2 Q6ZVD8 2/20 0.43
▸ NPC1 O15118 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ CASR P41180 1/20 0.36
▸ MAPK1 P28482 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.34
▸ CASP6 P55212 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34

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
SCHEMBL13879699 0.80 ENPP2 (0.48) ENPP2PHLPP2MAPTMAPK1ALDH1A1
SCHEMBL14026027 0.78 ENPP2 (0.49) ENPP2PHLPP2HTTALDH1A1MEN1
SCHEMBL14469830 0.78 ENPP2 (0.57) ENPP2PHLPP2CASP6
SCHEMBL10448648 0.77 ENPP2 (0.54) ENPP2PHLPP2NPC1MAPTHTT
SCHEMBL9179502 0.77 ENPP2 (0.54) ENPP2PHLPP2NPC1MAPTHTT
SCHEMBL13879698 0.77 PHLPP2 (0.45) ENPP2PHLPP2MAPTHTTMAPK1
SCHEMBL8022246 0.75 ENPP2 (0.53) ENPP2PHLPP2MAPTHTTMAPK1
SCHEMBL8022243 0.75 ENPP2 (0.53) ENPP2PHLPP2MAPTHTTMAPK1
SCHEMBL6125350 0.75 S1PR3 (0.47) ENPP2PHLPP2HTTMAPK1ALDH1A1
SCHEMBL13811608 0.75 S1PR3 (0.44) ENPP2PHLPP2HTTMAPK1ALDH1A1

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-20070166483-A1 Azo compound and polarizing film and polarizing plate each containing the same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2007-07-19 — — US disclosed
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