SCHEMBL1781744

SCHEMBL1781744

C=CC(=O)OCO[Si](OC)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.49
TGM2 P21980 1/20 0.33
TSHR P16473 7/20 0.33
ALDH1A1 P00352 6/20 0.32
GAA P10253 1/20 0.32
TP53 P04637 3/20 0.32
HIF1A Q16665 3/20 0.32
CYP3A4 P08684 2/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 0.32
THRA P10827 1/20 0.32
PDE6D O43924 1/20 0.31
POLB P06746 1/20 0.31
AKT1 P31749 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL1784170 0.91 THRB (0.54) THRBTGM2TSHRALDH1A1GAA
SCHEMBL230345 0.85 THRB (0.52) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL230456 0.81 ELANE (0.38) THRBTSHRALDH1A1POLB
SCHEMBL229251 0.77 THRB (0.51) THRBTGM2TSHRALDH1A1TP53
SCHEMBL28648452 0.77 THRB (0.44) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL231331 0.76 THRB (0.57) THRBTGM2TSHRALDH1A1GAA
SCHEMBL27863619 0.76 THRB (0.43) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL1642965 0.74 THRB (0.72) THRBTGM2TSHRALDH1A1GAA
SCHEMBL2582629 0.74 THRB (0.49) THRBTGM2ALDH1A1GAATP53
SCHEMBL229250 0.74 THRB (0.54) THRBTGM2TSHRALDH1A1TP53

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8247590-B2 Method for preventing polymerization of unsaturated organosilicon compounds WACKER CHEMIE AG (DE) 2012-08-21 US disclosed
US-20110118493-A1 METHOD FOR PREVENTING POLYMERIZATION OF UNSATURATED ORGANOSILICON COMPOUNDS WACKER CHEMIE AG (DE) 2011-05-19 US disclosed