SCHEMBL28249116

SCHEMBL28249116

C=CC(=O)OS(C)(C)C.[SiH4]

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.38
HPGD P15428 1/20 0.37
ALDH1A1 P00352 7/20 0.36
TP53 P04637 3/20 0.36
HIF1A Q16665 3/20 0.36
CYP3A4 P08684 2/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 2/20 0.31
FGFR4 P22455 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
SCHEMBL3399845 0.79
SCHEMBL27951964 0.77 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
Ammonia Solution, Strong SCHEMBL28223541 0.77 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2397256 0.72 TSHR (0.39) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL5873247 0.72 TSHR (0.34) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL8975780 0.70
SCHEMBL151093 0.70 TSHR (0.43) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL4142643 0.70 TSHR (0.35) TSHRHPGDALDH1A1TP53HIF1A
Acrylic Acid Methyl Ester SCHEMBL30706465 0.69
Acrylic Acid Methyl Ester SCHEMBL21272174 0.69

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-108878618-A A kind of QLED device and preparation method thereof TCL集团股份有限公司 2018-11-23 CN claimed
CN-108878618-A A kind of QLED device and preparation method thereof TCL集团股份有限公司 2018-11-23 CN disclosed