SCHEMBL13860824

SCHEMBL13860824

CNc1nc(Nc2cc(C(=O)O)cc(C(=O)O)c2)nc(Nc2ccc3c(O)c(N=Nc4ccc(N=Nc5ccc(N=Nc6cccc(SOOO)c6)cc5OC)c(C)c4)c(SOOO)cc3c2)n1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 6/20 0.37
▸ CARM1 Q86X55 1/20 0.34
▸ PRMT1 Q99873 1/20 0.34
▸ PHLPP2 Q6ZVD8 1/20 0.30

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
SCHEMBL13860869 0.82 ENPP2 (0.47) ENPP2CARM1PRMT1PHLPP2
SCHEMBL13860859 0.80 ENPP2 (0.45) ENPP2CARM1PRMT1PHLPP2
SCHEMBL13860826 0.79 ENPP2 (0.36) ENPP2PHLPP2
SCHEMBL13860873 0.77 ENPP2 (0.36) ENPP2PHLPP2
SCHEMBL13860883 0.77 ENPP2 (0.37) ENPP2
SCHEMBL13860845 0.77 CARM1 (0.39) ENPP2CARM1PRMT1PHLPP2
SCHEMBL13860889 0.77 ENPP2 (0.45) ENPP2PHLPP2
SCHEMBL13088658 0.75 ENPP2 (0.42) ENPP2CARM1PRMT1PHLPP2
SCHEMBL14001687 0.75 PHLPP2 (0.42) ENPP2CARM1PRMT1PHLPP2
SCHEMBL13860842 0.74 ENPP2 (0.44) ENPP2CARM1PRMT1PHLPP2

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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