SCHEMBL6687704

SCHEMBL6687704

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

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.37
HPGD P15428 1/20 0.36
ALDH1A1 P00352 4/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 1/20 0.31
THRB P10828 2/20 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
SCHEMBL1015617 0.81 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL8853600 0.81 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL1019122 0.78 TSHR (0.37) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL1015222 0.76 TSHR (0.36) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL5958279 0.76 TSHR (0.36) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL29022841 0.75 TSHR (0.39) TSHRHPGD
SCHEMBL28467863 0.75 TSHR (0.39) TSHRHPGD
SCHEMBL140889 0.75 TSHR (0.35) TSHRHPGD
SCHEMBL28352122 0.75 TSHR (0.36) TSHRHPGD
SCHEMBL28476202 0.74 TSHR (0.41) TSHRHPGDALDH1A1TP53HIF1A

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
WO-2004108770-A1 LOW ODOR CHAIN TRANSFER AGENTS FOR CONTROLLED RADICAL POLYMERIZATION RENSSELAER POLYTECHNIC INSTITUTE (US) 2004-12-16 WO disclosed