SCHEMBL13860859

SCHEMBL13860859

COc1cc(N=Nc2cccc(SOOO)c2)ccc1N=Nc1cc(OC)c(N=Nc2c(SOOO)cc3cc(Nc4nc(O)nc(Nc5cccc(S(=O)(=O)O)c5)n4)ccc3c2O)cc1OC

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 11/20 0.45
▸ PRMT1 Q99873 2/20 0.38
▸ CARM1 Q86X55 1/20 0.38
▸ CD40 P25942 1/20 0.35
▸ CD40LG P29965 1/20 0.35
▸ PHLPP2 Q6ZVD8 3/20 0.35
▸ PTPN11 Q06124 1/20 0.35
▸ PRMT3 O60678 1/20 0.32
▸ EP300 Q09472 1/20 0.32
▸ PRMT6 Q96LA8 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
SCHEMBL13860822 0.90 ENPP2 (0.53) ENPP2PRMT1CARM1CD40CD40LG
SCHEMBL13860884 0.90 ENPP2 (0.53) ENPP2PRMT1CARM1CD40CD40LG
SCHEMBL13935187 0.89 ENPP2 (0.54) ENPP2PRMT1CARM1CD40CD40LG
SCHEMBL13860869 0.87 ENPP2 (0.47) ENPP2PRMT1CARM1CD40CD40LG
SCHEMBL13860901 0.86 ENPP2 (0.40) ENPP2PRMT1CARM1CD40CD40LG
SCHEMBL13860871 0.85 ENPP2 (0.45) ENPP2PRMT1CARM1CD40CD40LG
SCHEMBL13860889 0.84 ENPP2 (0.45) ENPP2CD40CD40LGPHLPP2PTPN11
SCHEMBL13860845 0.83 CARM1 (0.39) ENPP2PRMT1CARM1CD40CD40LG
SCHEMBL13860870 0.81 ENPP2 (0.48) ENPP2PRMT1CARM1CD40CD40LG
SCHEMBL13860829 0.80 ENPP2 (0.44) ENPP2PRMT1CARM1CD40CD40LG

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-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
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