SCHEMBL28022548

SCHEMBL28022548

C=CC(=O)OCS(=O)(=O)Oc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.57
KMT2A Q03164 2/20 0.47
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
MEN1 O00255 1/20 0.40
PPARG P37231 2/20 0.38
LMNA P02545 1/20 0.38
NFE2L2 Q16236 1/20 0.38
TGM2 P21980 1/20 0.37
HTT P42858 2/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TSHR P16473 4/20 0.36
ALDH1A1 P00352 3/20 0.36
TP53 P04637 2/20 0.36
HIF1A Q16665 2/20 0.36
CYP3A4 P08684 2/20 0.36

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
SCHEMBL28767936 0.86 THRB (0.60) THRBKMT2ACA1CA2CA9
SCHEMBL17097123 0.81 THRB (0.55) THRBKMT2ATGM2HTTTSHR
SCHEMBL28838390 0.81 THRB (0.46) THRBKMT2ACA1CA2CA9
SCHEMBL15800929 0.80 CYP3A4 (0.46) THRBKMT2ACA1CA2CA9
SCHEMBL30055648 0.78 THRB (0.50) THRBKMT2ALMNAHTTRAB9A
SCHEMBL27466792 0.77 KMT2A (0.52) KMT2ACA1CA2CA9MEN1
SCHEMBL4071489 0.77 KMT2A (0.52) KMT2ACA1CA2CA9MEN1
Biphenyl SCHEMBL27622834 0.77 THRB (0.49) THRBLMNATGM2HTTGAA
SCHEMBL15800925 0.76 KMT2A (0.50) KMT2ACA1CA2CA9MEN1
SCHEMBL27952719 0.76 TDP1 (0.52) KMT2APPARGLMNAGAARAB9A

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
CN-104736603-A Polymerizable composition, and cured article MITSUBISHI GAS CHEMICAL CO 2015-06-24 CN disclosed