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Sugi Predict / Compounds / SCHEMBL13860819

SCHEMBL13860819

SCHEMBL13860819

OOOSc1ccc(N=Nc2ccc(N=Nc3ccc(N=Nc4c(SOOO)cc5cc(Nc6nc(O)nc(O)n6)ccc5c4O)c4ccc(SOOO)cc34)c3ccc(SOOO)cc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CARM1 Q86X55 1/20 0.37
▸ PRMT1 Q99873 1/20 0.37
▸ PTPN11 Q06124 1/20 0.33
▸ CD40 P25942 1/20 0.33
▸ CD40LG P29965 1/20 0.33

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
SCHEMBL13860862 0.93 PRMT1 (0.36) CARM1PRMT1PTPN11CD40CD40LG
SCHEMBL13860892 0.91 PRMT1 (0.40) CARM1PRMT1PTPN11CD40CD40LG
SCHEMBL13860845 0.82 CARM1 (0.39) CARM1PRMT1CD40CD40LG
SCHEMBL13860901 0.81 ENPP2 (0.40) CARM1PRMT1PTPN11CD40CD40LG
SCHEMBL13860891 0.81 CD40 (0.40) CARM1PRMT1PTPN11CD40CD40LG
SCHEMBL13318855 0.80 PHLPP2 (0.44) CARM1PRMT1PTPN11CD40CD40LG
SCHEMBL12724060 0.80 PHLPP2 (0.44) CARM1PRMT1PTPN11CD40CD40LG
SCHEMBL13860871 0.80 ENPP2 (0.45) CARM1PRMT1PTPN11CD40CD40LG
SCHEMBL13088656 0.79 PHLPP2 (0.38) CARM1PRMT1PTPN11CD40CD40LG
SCHEMBL14079940 0.79 PRMT1 (0.35) CARM1PRMT1PTPN11CD40CD40LG

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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