SCHEMBL139101

SCHEMBL139101

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

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 3/20 0.32
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 0.32
CYP3A4 P08684 1/20 0.32
HSD17B10 Q99714 1/20 0.32
THRB P10828 3/20 0.32
THRA P10827 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30

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
SCHEMBL140102 0.90 TSHR (0.50) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL8007977 0.89 TSHR (0.40) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL143214 0.86 TSHR (0.36) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28444360 0.82 TSHR (0.49) TSHRHPGD
SCHEMBL139741 0.81 TSHR (0.37) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28217128 0.80 TSHR (0.38) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL137712 0.78 TSHR (0.39) TSHRHPGD
SCHEMBL28025375 0.77 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2853098 0.77 TSHR (0.37) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL17002615 0.77 TSHR (0.39) TSHRALDH1A1THRB

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
CN-107709501-A acrylic emulsion adhesive 艾利丹尼森公司 2018-02-16 CN disclosed
US-20120059121-A1 Elastomer Compositions Modified By Silanes DOW CORNING EUROPE SA (BE) 2012-03-08 US disclosed