SCHEMBL13340871

SCHEMBL13340871

Nc1cc(Nc2cc(F)nc(F)n2)c(/N=N/c2ccc(S(=O)(=O)CCOSOOO)cc2)cc1S(=O)(=O)O

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.34
▸ PTPN11 Q06124 1/20 0.32
▸ SUMO2 P61956 1/20 0.31
▸ SUMO1 P63165 1/20 0.31
▸ SENP7 Q9BQF6 1/20 0.31
▸ SENP2 Q9HC62 1/20 0.31

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
SCHEMBL13340880 0.93 — —
SCHEMBL13341090 0.88 THRB (0.39) THRBPTPN11SUMO2SUMO1SENP7
SCHEMBL13340848 0.84 FUT8 (0.34) THRBPTPN11SUMO2SUMO1SENP7
SCHEMBL12053397 0.82 ENPP2 (0.44) THRBSUMO2SUMO1SENP7SENP2
SCHEMBL13340704 0.82 THRB (0.35) THRBPTPN11SUMO2SUMO1SENP7
SCHEMBL12053403 0.81 THRB (0.39) THRBPTPN11SUMO2SUMO1SENP7
SCHEMBL13341089 0.80 THRB (0.31) THRB
SCHEMBL13340927 0.78 ENPP2 (0.33) THRBPTPN11SUMO2SUMO1SENP7
SCHEMBL13340645 0.78 ENPP2 (0.33) THRBPTPN11SUMO2SUMO1SENP7
SCHEMBL13604281 0.77 — —

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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