SCHEMBL13868540

SCHEMBL13868540

COc1ccc(N=Nc2ccc(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 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 13/20 0.49
▸ CD40 P25942 1/20 0.44
▸ CD40LG P29965 1/20 0.44
▸ CASP6 P55212 1/20 0.40
▸ CTDSP1 Q9GZU7 1/20 0.40
▸ PRMT1 Q99873 2/20 0.37
▸ PRMT3 O60678 1/20 0.37
▸ EP300 Q09472 1/20 0.37
▸ PRMT6 Q96LA8 1/20 0.37
▸ CARM1 Q86X55 1/20 0.36
▸ PHLPP2 Q6ZVD8 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ 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
SCHEMBL13868539 0.97 ENPP2 (0.47) ENPP2CD40CD40LGCASP6CTDSP1
SCHEMBL13868536 0.94 ENPP2 (0.52) ENPP2CD40CD40LGPRMT1PRMT3
SCHEMBL13868541 0.93 ENPP2 (0.49) ENPP2CD40CD40LGCASP6CTDSP1
SCHEMBL13868538 0.93 ENPP2 (0.52) ENPP2CD40CD40LGCASP6CTDSP1
SCHEMBL14470019 0.90 ENPP2 (0.59) ENPP2CD40CD40LGCASP6CTDSP1
SCHEMBL19234803 0.87 ENPP2 (0.57) ENPP2CD40CD40LGCASP6CTDSP1
SCHEMBL13879482 0.87 ENPP2 (0.57) ENPP2CD40CD40LGCASP6CTDSP1
SCHEMBL13868537 0.86 ENPP2 (0.40) ENPP2CD40CD40LGCASP6CTDSP1
SCHEMBL14001676 0.85 ENPP2 (0.53) ENPP2CD40CD40LGPRMT1CARM1
SCHEMBL13088669 0.85 ENPP2 (0.49) ENPP2CD40CD40LGPRMT1PRMT3

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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