SCHEMBL13868539

SCHEMBL13868539

COc1ccc(N=Nc2cc(C)c(N=Nc3cc(C)c(N=Nc4c(SOOO)cc5cc(NC(=O)c6ccc(N)cc6)ccc5c4O)cc3C)cc2C)c(S(=O)(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 11/20 0.47
▸ CASP6 P55212 1/20 0.42
▸ CTDSP1 Q9GZU7 1/20 0.42
▸ CD40 P25942 1/20 0.42
▸ CD40LG P29965 1/20 0.42
▸ PHLPP2 Q6ZVD8 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TNIK Q9UKE5 1/20 0.36
▸ PRMT3 O60678 1/20 0.36
▸ EP300 Q09472 1/20 0.36
▸ PRMT6 Q96LA8 1/20 0.36
▸ PRMT1 Q99873 1/20 0.36
▸ HIF1A Q16665 1/20 0.35

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
SCHEMBL13868541 0.97 ENPP2 (0.49) ENPP2CASP6CTDSP1CD40CD40LG
SCHEMBL13868540 0.97 ENPP2 (0.49) ENPP2CASP6CTDSP1CD40CD40LG
SCHEMBL13868536 0.90 ENPP2 (0.52) ENPP2CD40CD40LGALDH1A1PRMT3
SCHEMBL19234803 0.90 ENPP2 (0.57) ENPP2CASP6CTDSP1CD40CD40LG
SCHEMBL13879482 0.90 ENPP2 (0.57) ENPP2CASP6CTDSP1CD40CD40LG
SCHEMBL13868538 0.89 ENPP2 (0.52) ENPP2CASP6CTDSP1CD40CD40LG
SCHEMBL14001676 0.88 ENPP2 (0.53) ENPP2CD40CD40LGPHLPP2ALDH1A1
SCHEMBL13088669 0.88 ENPP2 (0.49) ENPP2CD40CD40LGPHLPP2ALDH1A1
SCHEMBL14001674 0.87 ENPP2 (0.45) ENPP2CTDSP1CD40CD40LGPHLPP2
SCHEMBL13880568 0.86 ENPP2 (0.59) ENPP2CASP6CTDSP1CD40CD40LG

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-7514129-B2 Azo compound and polarizing film and polarizing plate each containing the same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-04-07 — — US disclosed
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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