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Acrylic Acid Methyl Ester

Acrylic Acid Methyl Ester

SCHEMBL28077203

C=C(CC(=O)OC(=O)/C=C\C(=O)OC(=O)CC(=C)C(=O)O)C(=O)O.C=CC(=O)OC.C=CC(=O)OC.C=CC(=O)OC.C=CC(=O)OC.CC=CC(=O)O.CC=CC(=O)O

nearest known ligand 0.40

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Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ HCAR2 Q8TDS4 3/20 0.40
▸ KEAP1 Q14145 1/20 0.32
▸ NFE2L2 Q16236 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TDP1 Q9NUW8 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
SCHEMBL2128323 0.83 ALOX15 (0.38) ALOX15HSD17B10
SCHEMBL27456989 0.83 ALOX15 (0.38) ALOX15HSD17B10
SCHEMBL27723028 0.82 ALOX15 (0.37) ALOX15HSD17B10
SCHEMBL28080156 0.80 ALOX15 (0.42) ALOX15HSD17B10HCAR2KDM4EALDH1A1
SCHEMBL17010769 0.80 ALOX15 (0.42) ALOX15HSD17B10HCAR2KDM4EALDH1A1
SCHEMBL28080246 0.80 ALOX15 (0.42) ALOX15HSD17B10HCAR2KDM4EALDH1A1
Acrylic Acid Methyl Ester SCHEMBL27534187 0.80 HCAR2 (0.54) ALOX15HSD17B10HCAR2KEAP1NFE2L2
Crotonic Acid SCHEMBL28156701 0.80 HCAR2 (0.54) ALOX15HSD17B10HCAR2KEAP1NFE2L2
SCHEMBL2193808 0.80 ALOX15 (0.43) ALOX15HSD17B10HCAR2KEAP1NFE2L2
SCHEMBL3879634 0.78 HSD17B10 (0.52) ALOX15HSD17B10ALDH1A1TDP1

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-103153952-B The oxime ester derivative of benzo carbazole compound and in photopolymerisable compositions as the purposes of photoinitiator 巴斯夫欧洲公司 2016-07-13 — — CN disclosed