SCHEMBL9054922

SCHEMBL9054922

O=S(=O)(O)c1cccc2cccc(OS(=O)(=O)c3[c]ccc4ccccc34)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.41
FABP4 P15090 1/20 0.41
CCNA2 P20248 1/20 0.41
CDK2 P24941 1/20 0.41
MAPK14 Q16539 1/20 0.41
NR4A1 P22736 1/20 0.40
FABP1 P07148 1/20 0.39
MEN1 O00255 1/20 0.36
ESR1 P03372 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
ESR2 Q92731 1/20 0.36
F2 P00734 3/20 0.35
PRSS1 P07477 3/20 0.35
PRSS2 P07478 3/20 0.35
PRSS3 P35030 3/20 0.35
HTR6 P50406 1/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 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
SCHEMBL6743138 0.76 METAP2 (0.51) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL6629829 0.75 TTR (0.46) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL760004 0.73 CYP2D6 (0.39) NR4A1GAAKMT2AF2PRSS1
SCHEMBL5465505 0.72 CYP2D6 (0.38) NR4A1GAAKMT2AF2PRSS1
SCHEMBL6742392 0.72 HTR6 (0.46) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL28040872 0.72 KMT2A (0.50) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL15851413 0.70 TTR (0.54) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL482422 0.70 KMT2A (0.53) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL6633176 0.70 TTR (0.50) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL4079124 0.69 KMT2A (0.52) TTRFABP4CCNA2CDK2MAPK14

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-0728817-A2 Monoazo compounds and dyeing or printing methods using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-08-28 EP disclosed