SCHEMBL14388751

SCHEMBL14388751

COc1cc(S(=O)(=O)CCOS(=O)(=O)O)c(OC)cc1/N=N/c1c(S(=O)(=O)O)cc2c(/N=N/c3ccc(S(=O)(=O)CCOS(=O)(=O)O)cc3)c(N)ccc2c1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 5/20 0.45
▸ THRB P10828 2/20 0.43
▸ PHLPP2 Q6ZVD8 3/20 0.41
▸ PTPN1 P18031 2/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA3 P07451 1/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ HSD17B10 Q99714 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ APEX1 P27695 1/20 0.37
▸ BRCA1 P38398 1/20 0.37
▸ RECQL P46063 1/20 0.37

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
SCHEMBL14388815 0.93 ENPP2 (0.44) ENPP2THRBPHLPP2PTPN1MEN1
SCHEMBL15985946 0.93 ENPP2 (0.44) ENPP2THRBPHLPP2PTPN1MEN1
SCHEMBL16838464 0.90 ENPP2 (0.40) ENPP2THRBPHLPP2PTPN1CA2
SCHEMBL17384282 0.90 ENPP2 (0.46) ENPP2THRBPHLPP2PTPN1MEN1
SCHEMBL17384275 0.89 PHLPP2 (0.44) ENPP2THRBPHLPP2PTPN1MEN1
SCHEMBL14388927 0.88 THRB (0.50) ENPP2THRBPHLPP2CA2CA3
SCHEMBL13387224 0.87 THRB (0.38) ENPP2THRBPHLPP2PTPN1CA2
SCHEMBL15985943 0.87 ENPP2 (0.43) ENPP2THRBPHLPP2PTPN1MEN1
SCHEMBL14388952 0.87 ENPP2 (0.43) ENPP2THRBPHLPP2PTPN1MEN1
SCHEMBL17384126 0.86 ENPP2 (0.44) ENPP2THRBPHLPP2CA2CA3

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
US-20070271711-A1 Dye Mixtures of Fibre-Reactive Azo Dyes Production and Use Thereof DYSTAR TEXTILFARBEN GMBH & CO., DEUTSCHLAND KG (DE) 2007-11-29 — — US disclosed
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