SCHEMBL28039296

SCHEMBL28039296

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

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.67
HPGD P15428 1/20 0.67
ALDH1A1 P00352 5/20 0.56
TP53 P04637 3/20 0.56
HIF1A Q16665 3/20 0.56
CYP3A4 P08684 2/20 0.56
HSD17B10 Q99714 1/20 0.56
HCAR2 Q8TDS4 4/20 0.50
THRB P10828 3/20 0.50
ATM Q13315 1/20 0.43
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
APP P05067 1/20 0.37
ALOX5 P09917 1/20 0.36

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
SCHEMBL30074662 0.93 TSHR (0.75) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL14982 0.93
Potassium SCHEMBL31216415 0.91
Fluoride SCHEMBL31484744 0.91
Lithium SCHEMBL31602240 0.91
Hydrochloric Acid SCHEMBL15846411 0.91
Ethylene SCHEMBL7197435 0.91 TSHR (0.72) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2546168 0.91
Ammonia Solution, Strong SCHEMBL22686891 0.91
SCHEMBL1035378 0.91

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105086129-A Anti-static halogen-free flame-retardant polypropylene composition and preparation method YUYAO ZHONGFA ENGINEERING PLASTICS CO LTD 2015-11-25 CN claimed
CN-110230058-A Promote the method for the medical titanium alloy surface building of growth of marrow mesenchyme stem cell differentiation 上海交通大学 2019-09-13 CN disclosed
CN-105086129-A Anti-static halogen-free flame-retardant polypropylene composition and preparation method YUYAO ZHONGFA ENGINEERING PLASTICS CO LTD 2015-11-25 CN disclosed
CN-103642063-B A kind of preparation method of methyl p-hydroxybenzoate molecularly imprinted composite membrane and application thereof JIANGSU UNIVERSITY (CN) 2015-11-18 CN disclosed