SCHEMBL13860891

SCHEMBL13860891

CNc1nc(O)nc(Nc2ccc3c(O)c(N=Nc4c(OC)cc(N=Nc5ccc(N=Nc6ccc(SOOO)cc6)cc5S(=O)(=O)O)c5cc(SOOO)ccc45)c(SOOO)cc3c2)n1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CD40 P25942 1/20 0.40
▸ CD40LG P29965 1/20 0.40
▸ PRMT1 Q99873 2/20 0.38
▸ CARM1 Q86X55 1/20 0.38
▸ ENPP2 Q13822 11/20 0.37
▸ PTPN11 Q06124 1/20 0.36
▸ PHLPP2 Q6ZVD8 2/20 0.32
▸ PRMT3 O60678 1/20 0.32
▸ EP300 Q09472 1/20 0.32
▸ PRMT6 Q96LA8 1/20 0.32
▸ MPL P40238 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
SCHEMBL13860845 0.81 CARM1 (0.39) CD40CD40LGPRMT1CARM1ENPP2
SCHEMBL13860819 0.81 CARM1 (0.37) CD40CD40LGPRMT1CARM1PTPN11
SCHEMBL13860842 0.80 ENPP2 (0.44) CD40CD40LGPRMT1CARM1ENPP2
SCHEMBL13860822 0.80 ENPP2 (0.53) CD40CD40LGPRMT1CARM1ENPP2
SCHEMBL13860884 0.80 ENPP2 (0.53) CD40CD40LGPRMT1CARM1ENPP2
SCHEMBL13860859 0.80 ENPP2 (0.45) CD40CD40LGPRMT1CARM1ENPP2
SCHEMBL13860840 0.78 PRMT1 (0.39) CD40CD40LGPRMT1CARM1ENPP2
SCHEMBL13860892 0.77 PRMT1 (0.40) CD40CD40LGPRMT1CARM1ENPP2
SCHEMBL13860901 0.77 ENPP2 (0.40) CD40CD40LGPRMT1CARM1ENPP2
SCHEMBL13860871 0.77 ENPP2 (0.45) CD40CD40LGPRMT1CARM1ENPP2

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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