SCHEMBL11893260

SCHEMBL11893260

CC(Nc1nc(Nc2ccc(N=Nc3ccc4c(S(=O)(=O)O)cc(S(=O)(=O)O)cc4c3)cc2)nc(Nc2ccc(N=Nc3ccc(S(=O)(=O)O)cc3)cc2S(=O)(=O)O)n1)S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CD40 P25942 1/20 0.41
▸ CD40LG P29965 1/20 0.41
▸ CHAT P28329 4/20 0.40
▸ USP2 O75604 1/20 0.40
▸ APEX1 P27695 1/20 0.40
▸ ENPP2 Q13822 7/20 0.39
▸ FUT8 Q9BYC5 1/20 0.38
▸ SUMO2 P61956 1/20 0.36
▸ SUMO1 P63165 1/20 0.36
▸ SENP7 Q9BQF6 1/20 0.36
▸ SENP2 Q9HC62 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ CARM1 Q86X55 1/20 0.35
▸ PRMT1 Q99873 1/20 0.35
▸ PTPRC P08575 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ PTPN6 P29350 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
SCHEMBL12848394 0.94 CHAT (0.41) CD40CD40LGCHATUSP2APEX1
SCHEMBL11893253 0.91 CHAT (0.42) CD40CD40LGCHATUSP2APEX1
SCHEMBL11893167 0.87 CHAT (0.41) CD40CD40LGCHATUSP2APEX1
SCHEMBL13219112 0.86 ENPP2 (0.35) CD40CD40LGCHATUSP2APEX1
SCHEMBL12848075 0.85 ENPP2 (0.49) CD40CD40LGCHATUSP2APEX1
SCHEMBL11893243 0.84 ENPP2 (0.44) CD40CD40LGCHATUSP2APEX1
SCHEMBL13218696 0.82 CD40 (0.38) CD40CD40LGENPP2FUT8PTPRC
SCHEMBL13219113 0.82 ENPP2 (0.36) CD40CD40LGENPP2FUT8PTPRC
SCHEMBL12848441 0.81 ATIC (0.48) CD40CD40LGCHATUSP2APEX1
SCHEMBL13151870 0.81 CHAT (0.50) CD40CD40LGCHATUSP2APEX1

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-8226222-B2 Ink set, recording method, and colored object NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2012-07-24 — — US disclosed
US-20110032302-A1 INK SET, RECORDING METHOD, AND COLORED OBJECT NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-02-10 — — US disclosed
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