SCHEMBL14565614

SCHEMBL14565614

Nc1c(N=Nc2ccc(S(=O)(=O)C(CO)(CO)S(=O)(=O)O)cc2S(=O)(=O)O)cc(S(=O)(=O)O)c(N)c1N=Nc1ccc(S(=O)(=O)CCOS(=O)(=O)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 5/20 0.45
▸ THRB P10828 2/20 0.41
▸ PHLPP2 Q6ZVD8 3/20 0.40
▸ APP P05067 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ ALOX12 P18054 1/20 0.37
▸ SNCA P37840 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ SLC7A11 Q9UPY5 3/20 0.36
▸ SENP2 Q9HC62 5/20 0.34
▸ SUMO2 P61956 4/20 0.34
▸ SUMO1 P63165 4/20 0.34
▸ SENP7 Q9BQF6 4/20 0.34
▸ SENP1 Q9P0U3 4/20 0.34

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
SCHEMBL13880627 0.90 ENPP2 (0.52) ENPP2THRBPHLPP2APPMEN1
SCHEMBL14646366 0.88 SENP2 (0.42) ENPP2THRBPHLPP2APPMEN1
SCHEMBL13604262 0.87 THRB (0.51) ENPP2THRBPHLPP2APPMEN1
SCHEMBL13792698 0.87 THRB (0.51) ENPP2THRBPHLPP2APPMEN1
SCHEMBL14557133 0.86 THRB (0.38) ENPP2THRBPHLPP2SLC7A11SENP2
SCHEMBL17109639 0.86 ENPP2 (0.48) ENPP2THRBPHLPP2APPMEN1
SCHEMBL14546784 0.86 THRB (0.48) ENPP2THRBPHLPP2APPMEN1
SCHEMBL14546752 0.86 THRB (0.48) ENPP2THRBPHLPP2APPMEN1
SCHEMBL17384340 0.85 ENPP2 (0.46) ENPP2THRBPHLPP2APPMEN1
SCHEMBL13793489 0.82 THRB (0.47) ENPP2THRBPHLPP2APPMEN1

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
EP-1760117-A2 Reactive dyestuff compositions and their use Everlight USA, Inc. (US) 2007-03-07 — — EP disclosed
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