SCHEMBL13340693

SCHEMBL13340693

Nc1ccc2ccc(S(=O)(=O)O)cc2c1/N=N/c1cc(Nc2nc(F)nc(Nc3ccc(S(=O)(=O)CCOS(=O)(=O)O)cc3)n2)ccc1S(=O)(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 4/20 0.37
▸ SENP2 Q9HC62 6/20 0.36
▸ SENP1 Q9P0U3 5/20 0.36
▸ SUMO2 P61956 4/20 0.36
▸ SUMO1 P63165 4/20 0.36
▸ SENP7 Q9BQF6 4/20 0.36
▸ SENP3 Q9H4L4 4/20 0.36
▸ FUT8 Q9BYC5 1/20 0.35
▸ CA12 O43570 3/20 0.35
▸ CA1 P00915 3/20 0.35
▸ CA2 P00918 3/20 0.35
▸ CA4 P22748 3/20 0.35
▸ CA6 P23280 3/20 0.35
▸ CA7 P43166 3/20 0.35
▸ CA9 Q16790 3/20 0.35
▸ CA14 Q9ULX7 3/20 0.35
▸ CA3 P07451 2/20 0.35
▸ CA5A P35218 2/20 0.35
▸ CA13 Q8N1Q1 2/20 0.34
▸ THRB P10828 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
SCHEMBL16560580 0.87 ENPP2 (0.44) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL14547014 0.84 FUT8 (0.42) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL16557855 0.83 THRB (0.41) ENPP2SENP2SUMO2SUMO1SENP7
SCHEMBL14441347 0.82 ENPP2 (0.49) ENPP2SENP2SUMO2SUMO1SENP7
SCHEMBL14546967 0.82 CA9 (0.36) FUT8CA12CA1CA2CA4
SCHEMBL14546911 0.81 CA1 (0.36) ENPP2FUT8CA12CA1CA2
SCHEMBL14388839 0.81 THRB (0.56) ENPP2FUT8CA2CA3THRB
SCHEMBL16560577 0.80 FUT8 (0.45) ENPP2SENP2SENP1SUMO2SUMO1
SCHEMBL21239135 0.79 CTDSP1 (0.39) CA12CA1CA2CA4CA6
SCHEMBL16560657 0.78 FUT8 (0.44) ENPP2FUT8CA12CA1CA2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7708786-B2 Dye mixtures of fiber-reactive azo dyes, their preparation and use DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2010-05-04 — — US disclosed
US-20090025152-A1 DYE MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND USE DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2009-01-29 — — US disclosed
US-7455699-B2 Dye mixtures of fiber-reactive azo dyes, their preparation and use DYSTAR TEXILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2008-11-25 — — US disclosed
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