SCHEMBL13386969

SCHEMBL13386969

Nc1c(N=Nc2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2)c(N)c(N=Nc2ccccc2S(=O)(=O)O)c(C(=O)O)c1N=Nc1ccc(S(=O)(=O)CCOS(=O)(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.43
▸ MEN1 O00255 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ APP P05067 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ SNCA P37840 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ ENPP2 Q13822 2/20 0.39
▸ SLC7A11 Q9UPY5 3/20 0.38
▸ CYP1A2 P05177 3/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ STAT6 P42226 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ SENP2 Q9HC62 4/20 0.38
▸ SENP1 Q9P0U3 3/20 0.38

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
SCHEMBL15671902 1.00 THRB (0.43) THRBMEN1MAPTKMT2ATDP1
SCHEMBL14159095 1.00 THRB (0.43) THRBMEN1MAPTKMT2ATDP1
SCHEMBL13387236 0.96 PHLPP2 (0.42) THRBMEN1MAPTKMT2ATDP1
SCHEMBL24019203 0.91 THRB (0.45) THRBMEN1MAPTKMT2ATDP1
SCHEMBL15671887 0.89 THRB (0.48) THRBMEN1MAPTKMT2ATDP1
SCHEMBL14159105 0.87 PHLPP2 (0.53) THRBMEN1MAPTKMT2ATDP1
SCHEMBL17384289 0.87 THRB (0.45) THRBMEN1MAPTKMT2ATDP1
SCHEMBL13793163 0.87 THRB (0.43) THRBMEN1MAPTKMT2ATDP1
SCHEMBL14159117 0.87 PHLPP2 (0.52) THRBMEN1MAPTKMT2ATDP1
SCHEMBL17384215 0.86 THRB (0.43) THRBMEN1MAPTKMT2ATDP1

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-7704287-B2 Reactive red dye composition and application thereof EVERLIGHT USA, INC. (US) 2010-04-27 — — US disclosed
US-20080127433-A1 Reactive red dye composition and application thereof EVERLIGHT USA, INC. (US) 2008-06-05 — — US disclosed
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