SCHEMBL14547014

SCHEMBL14547014

Nc1ccc2cc(/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)CCOS(=O)(=O)O)cc1S(=O)(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.42
▸ ENPP2 Q13822 2/20 0.36
▸ CHAT P28329 3/20 0.35
▸ USP2 O75604 1/20 0.35
▸ APEX1 P27695 1/20 0.35
▸ CA9 Q16790 11/20 0.34
▸ CA12 O43570 10/20 0.34
▸ CA1 P00915 10/20 0.34
▸ CA2 P00918 10/20 0.34
▸ CA14 Q9ULX7 5/20 0.34
▸ SUMO2 P61956 2/20 0.34
▸ SUMO1 P63165 2/20 0.34
▸ SENP7 Q9BQF6 2/20 0.34
▸ SENP2 Q9HC62 2/20 0.34
▸ SENP3 Q9H4L4 1/20 0.34
▸ SENP1 Q9P0U3 1/20 0.34
▸ CA5A P35218 1/20 0.33
▸ CA5B Q9Y2D0 1/20 0.33
▸ CARM1 Q86X55 1/20 0.33
▸ PRMT1 Q99873 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
SCHEMBL14388949 0.90 FUT8 (0.44) FUT8ENPP2CHATUSP2APEX1
SCHEMBL14546956 0.90 FUT8 (0.41) FUT8CHATUSP2APEX1CA9
SCHEMBL14388918 0.86 FUT8 (0.41) FUT8ENPP2CHATUSP2APEX1
SCHEMBL16560577 0.85 FUT8 (0.45) FUT8ENPP2CHATUSP2APEX1
SCHEMBL14514299 0.85 FUT8 (0.54) FUT8ENPP2CHATUSP2APEX1
SCHEMBL14441347 0.85 ENPP2 (0.49) FUT8ENPP2CHATUSP2APEX1
SCHEMBL13340693 0.84 ENPP2 (0.37) FUT8ENPP2CHATUSP2APEX1
SCHEMBL14693000 0.83 CA9 (0.42) FUT8CHATUSP2APEX1CA9
SCHEMBL12053285 0.83 FUT8 (0.36) FUT8ENPP2CARM1PRMT1
SCHEMBL14362766 0.83 FUT8 (0.36) FUT8ENPP2CARM1PRMT1

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
WO-2007039573-A2 AZO REACTIVE DYES AND MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND THEIR USE DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2007-04-12 — — WO disclosed
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