SCHEMBL13341090

SCHEMBL13341090

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.39
▸ SENP2 Q9HC62 4/20 0.34
▸ SUMO2 P61956 3/20 0.34
▸ SUMO1 P63165 3/20 0.34
▸ SENP7 Q9BQF6 3/20 0.34
▸ ENPP2 Q13822 2/20 0.32
▸ SLC7A11 Q9UPY5 3/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ APP P05067 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX12 P18054 1/20 0.32
▸ SNCA P37840 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ PTPRC P08575 1/20 0.31
▸ ALOX15 P16050 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
SCHEMBL13341089 0.92 THRB (0.31) THRBENPP2
SCHEMBL13340871 0.88 THRB (0.34) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL13341084 0.82 THRB (0.39) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL13340880 0.80 — —
SCHEMBL3424810 0.80 THRB (0.46) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL3424812 0.80 THRB (0.46) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL13793399 0.80 ENPP2 (0.49) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL13880623 0.80 ENPP2 (0.49) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL13367614 0.79 CA2 (0.32) THRBCA2
SCHEMBL12052897 0.79 THRB (0.45) THRBSENP2SUMO2SUMO1SENP7

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-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
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