SCHEMBL14546965

SCHEMBL14546965

CNc1c(/N=N/c2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2S(=O)(=O)O)cc(/N=N/c2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2)c(N)c1/N=N/c1ccc(S(=O)(=O)CCOS(=O)(=O)O)cc1S(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.43
▸ ENPP2 Q13822 3/20 0.41
▸ PHLPP2 Q6ZVD8 2/20 0.40
▸ SENP2 Q9HC62 4/20 0.36
▸ SLC7A11 Q9UPY5 3/20 0.36
▸ SUMO2 P61956 3/20 0.36
▸ SUMO1 P63165 3/20 0.36
▸ SENP7 Q9BQF6 3/20 0.36
▸ CD40 P25942 1/20 0.35
▸ CD40LG P29965 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ APP P05067 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ALOX12 P18054 1/20 0.35
▸ SNCA P37840 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ BLM P54132 1/20 0.35
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL14546966 1.00 THRB (0.43) THRBENPP2PHLPP2SENP2SLC7A11
SCHEMBL14546985 1.00 THRB (0.43) THRBENPP2PHLPP2SENP2SLC7A11
SCHEMBL14546918 0.95 THRB (0.36) THRBENPP2PHLPP2SENP2SUMO2
SCHEMBL12053049 0.91 THRB (0.38) THRBENPP2PHLPP2SENP2SLC7A11
SCHEMBL12053044 0.91 THRB (0.38) THRBENPP2PHLPP2SENP2SLC7A11
SCHEMBL12053051 0.91 THRB (0.38) THRBENPP2PHLPP2SENP2SLC7A11
SCHEMBL14546752 0.91 THRB (0.48) THRBENPP2PHLPP2SENP2SLC7A11
SCHEMBL14546784 0.91 THRB (0.48) THRBENPP2PHLPP2SENP2SLC7A11
SCHEMBL14546919 0.90 THRB (0.43) THRBENPP2PHLPP2SENP2SLC7A11
SCHEMBL14546963 0.90 THRB (0.43) THRBENPP2PHLPP2SENP2SLC7A11

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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