SCHEMBL14388949

SCHEMBL14388949

Nc1ccc2c(O)c(/N=N/c3cc(Nc4nc(Cl)nc(Nc5ccc(S(=O)(=O)CCOS(=O)(=O)O)cc5)n4)ccc3S(=O)(=O)O)c(S(=O)(=O)O)cc2c1/N=N/c1ccc(S(=O)(=O)CCS(=O)(=O)O)cc1S(=O)(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.44
▸ ENPP2 Q13822 7/20 0.37
▸ CARM1 Q86X55 1/20 0.37
▸ PRMT1 Q99873 1/20 0.37
▸ CD40 P25942 1/20 0.36
▸ CD40LG P29965 1/20 0.36
▸ CHAT P28329 2/20 0.32
▸ USP2 O75604 1/20 0.32
▸ APEX1 P27695 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ SUMO2 P61956 1/20 0.31
▸ SUMO1 P63165 1/20 0.31
▸ SENP7 Q9BQF6 1/20 0.31
▸ SENP3 Q9H4L4 1/20 0.31
▸ SENP2 Q9HC62 1/20 0.31
▸ SENP1 Q9P0U3 1/20 0.31
▸ CA9 Q16790 4/20 0.30
▸ CA12 O43570 3/20 0.30
▸ CA1 P00915 3/20 0.30
▸ CA2 P00918 3/20 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
SCHEMBL14388918 0.91 FUT8 (0.41) FUT8ENPP2CARM1PRMT1CD40
SCHEMBL14547014 0.90 FUT8 (0.42) FUT8ENPP2CARM1PRMT1CHAT
SCHEMBL14514299 0.85 FUT8 (0.54) FUT8ENPP2CARM1PRMT1CD40
SCHEMBL14362766 0.85 FUT8 (0.36) FUT8ENPP2CARM1PRMT1
SCHEMBL12053285 0.85 FUT8 (0.36) FUT8ENPP2CARM1PRMT1
SCHEMBL16560577 0.84 FUT8 (0.45) FUT8ENPP2CARM1PRMT1CD40
SCHEMBL14546956 0.84 FUT8 (0.41) FUT8CHATUSP2APEX1CA9
SCHEMBL14388920 0.83 FUT8 (0.54) FUT8ENPP2CARM1PRMT1CD40
SCHEMBL14547040 0.83 FUT8 (0.41) FUT8ENPP2CARM1PRMT1CD40
SCHEMBL14388817 0.83 FUT8 (0.41) FUT8ENPP2CARM1PRMT1CD40

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-20070271711-A1 Dye Mixtures of Fibre-Reactive Azo Dyes Production and Use Thereof DYSTAR TEXTILFARBEN GMBH & CO., DEUTSCHLAND KG (DE) 2007-11-29 — — US disclosed
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