SCHEMBL229761

SCHEMBL229761

C=CC(=O)OCCC[SiH2]OC(C)CC

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.53
HPGD P15428 1/20 0.53
ALDH1A1 P00352 4/20 0.49
CYP3A4 P08684 2/20 0.49
TP53 P04637 3/20 0.41
HIF1A Q16665 3/20 0.41
HSD17B10 Q99714 1/20 0.41
THRB P10828 2/20 0.39
ATM Q13315 1/20 0.36
HCAR2 Q8TDS4 3/20 0.33
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL27541005 0.87 TSHR (0.47) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL7879592 0.86 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL1014595 0.86 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL2496766 0.84 TSHR (0.52) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL7880363 0.82 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL20555649 0.81 TSHR (0.51) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL1803889 0.80 TSHR (0.53) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL22115829 0.79 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL22115824 0.78 TSHR (0.61) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL7511201 0.78 TSHR (0.52) TSHRHPGDALDH1A1CYP3A4TP53

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-20120004437-A1 METHOD FOR PRODUCING (METH)ACRYLOSILANES WACKER CHEMIE AG (DE) 2012-01-05 US disclosed