Acrylic Acid Methyl Ester

Acrylic Acid Methyl Ester

SCHEMBL28167136

C=C(C)C(=O)OCC(F)(F)C(F)F.C=CC(=O)OC.CCOC(C)=O

nearest known ligand 0.34

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.34
LMNA P02545 2/20 0.34
HSD17B10 Q99714 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
THRB P10828 2/20 0.33
MAPK1 P28482 1/20 0.33
TSHR P16473 3/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 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
Acrylic Acid Methyl Ester SCHEMBL28209123 0.92 TSHR (0.37) ALDH1A1LMNAPOLBGAATHRB
SCHEMBL9242879 0.84 ALDH1A1 (0.41) ALDH1A1LMNAHSD17B10POLBGAA
SCHEMBL11035102 0.82 ALDH1A1 (0.43) ALDH1A1LMNAHSD17B10POLBGAA
SCHEMBL227643 0.80 TSHR (0.47) ALDH1A1LMNAPOLBGAATHRB
SCHEMBL14110057 0.79 TSHR (0.55) ALDH1A1HSD17B10POLBTHRBTSHR
Acrylic Acid Methyl Ester SCHEMBL6242496 0.79 ALDH1A1 (0.39) ALDH1A1HSD17B10THRBMAPK1TSHR
Acrylic Acid Methyl Ester SCHEMBL2118077 0.78 THRB (0.47) ALDH1A1LMNAHSD17B10GAATHRB
Acrylic Acid Methyl Ester SCHEMBL28173466 0.78 THRB (0.47) ALDH1A1LMNAHSD17B10GAATHRB
Acrylic Acid Methyl Ester SCHEMBL28166552 0.77 ALDH1A1 (0.58) ALDH1A1LMNAHSD17B10GAATHRB
SCHEMBL4972714 0.76 ALDH1A1 (0.34) ALDH1A1THRBMAPK1TSHR

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
CN-105122521-B Binder composition for lithium ion secondary battery, slurry composition for lithium ion secondary battery, electrode for lithium ion secondary battery, and method for producing binder composition for lithium ion secondary battery 日本瑞翁株式会社 2017-07-28 CN disclosed