Acrylic Acid Ethyl Ester

Acrylic Acid Ethyl Ester

SCHEMBL8921596

C=CC(=O)OCC.C=CC(=O)OCC.CC(C)(CC(=O)O)CC(=O)O

nearest known ligand 0.52

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.44
HPGD P15428 1/20 0.44
HCAR2 Q8TDS4 1/20 0.42
THRB P10828 2/20 0.41
ALDH1A1 P00352 5/20 0.40
HIF1A Q16665 4/20 0.40
TP53 P04637 3/20 0.40
CYP3A4 P08684 2/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.39
FFAR1 O14842 1/20 0.39
CPT2 P23786 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NPSR1 Q6W5P4 1/20 0.37
HMGCR P04035 1/20 0.35
CHRM1 P11229 1/20 0.35
TBXA2R P21731 1/20 0.35
ADRA1A P35348 1/20 0.35

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 Ethyl Ester SCHEMBL29739797 0.82 TSHR (0.56) TSHRHPGDHCAR2THRBALDH1A1
Acrylic Acid Ethyl Ester SCHEMBL8829513 0.82
Acrylic Acid Ethyl Ester SCHEMBL21715365 0.82 TSHR (0.56) TSHRHPGDHCAR2THRBALDH1A1
Acrylic Acid Ethyl Ester SCHEMBL3180 0.82
Acrylic Acid Ethyl Ester SCHEMBL8159679 0.82 TSHR (0.60) TSHRHPGDHCAR2THRBALDH1A1
Acrylic Acid Ethyl Ester SCHEMBL9557413 0.82 TSHR (0.60) TSHRHPGDHCAR2THRBALDH1A1
Acrylic Acid Ethyl Ester SCHEMBL27441501 0.81 TSHR (0.47) TSHRHPGDHCAR2THRBALDH1A1
Acrylic Acid Ethyl Ester SCHEMBL3872006 0.80 TSHR (0.50) TSHRHPGDHCAR2THRBALDH1A1
Acrylic Acid Ethyl Ester SCHEMBL8744229 0.80 TSHR (0.50) TSHRHPGDHCAR2THRBALDH1A1
Succinic Acid SCHEMBL1046259 0.80 TSHR (0.50) TSHRHPGDHCAR2THRBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5663032-A NAPHTHOL DERIVATIVE REDUCING AGENT CANON KABUSHIKI KAISHA (JP) 1997-09-02 US disclosed
US-5543286-A CONTAINING AN ORGANIC SILVER SALT AND A PYRROLE COMPOUND;HIGH CONTRAST IMAGES CANON KABUSHIKI KAISHA (JP) 1996-08-06 US disclosed
EP-0328364-B1 Photosensitive material CANON KK (JP) 1996-05-08 EP disclosed
US-5073791-A IMAGE FORMING DEVICE CANON KABUSHIKI KAISHA (JP) 1991-12-17 US disclosed
EP-0410803-A2 Image forming device CANON KABUSHIKI KAISHA (JP) 1991-01-30 EP disclosed
EP-0326424-A2 Photosensitive composition, photosensitive material, and image forming method CANON KABUSHIKI KAISHA (JP) 1989-08-02 EP disclosed