Acrylic Acid Ethyl Ester

Acrylic Acid Ethyl Ester

SCHEMBL8861606

C=C(C)C(=O)Oc1c(Cl)cccc1Cl.C=CC(=O)OCC

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
CASP1 P29466 1/20 0.41
LMNA P02545 2/20 0.38
ALDH1A1 P00352 6/20 0.38
TDP1 Q9NUW8 1/20 0.37
NLRP3 Q96P20 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GPR35 Q9HC97 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 2/20 0.35
THRB P10828 2/20 0.35
ELANE P08246 1/20 0.34
KDM4E B2RXH2 2/20 0.34
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 2/20 0.34

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
SCHEMBL8530339 0.83 ELANE (0.45) CASP1LMNAALDH1A1KMT2AELANE
Acrylic Acid Ethyl Ester SCHEMBL6545321 0.77 ELANE (0.50) MAPTLMNAALDH1A1TDP1KMT2A
SCHEMBL8528074 0.77 KDM4E (0.42) MAPTL3MBTL1CASP1ALDH1A1SMN1; SMN2
Acrylic Acid Ethyl Ester SCHEMBL28338577 0.77 MAPT (0.48) MAPTL3MBTL1LMNAALDH1A1SMN1; SMN2
Acrylic Acid Ethyl Ester SCHEMBL669169 0.75 THRB (0.50) LMNAALDH1A1THRBCYP3A4HIF1A
Acrylic Acid Ethyl Ester SCHEMBL29290957 0.73 TSHR (0.46) MAPTLMNAALDH1A1SMN1; SMN2GAA
Acrylic Acid Ethyl Ester SCHEMBL8164350 0.73 MAPT (0.42) MAPTL3MBTL1LMNAALDH1A1TDP1
Acrylic Acid Ethyl Ester SCHEMBL3690840 0.73 ALDH1A1 (0.49) MAPTL3MBTL1LMNAALDH1A1TDP1
Acrylic Acid Ethyl Ester SCHEMBL11788641 0.72 CYP1A2 (0.46) MAPTL3MBTL1CASP1LMNAALDH1A1
Acrylic Acid Ethyl Ester SCHEMBL6573893 0.72 ALDH1A1 (0.56) LMNAALDH1A1GAATHRBCYP3A4

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
US-5652076-A Method for preparation of printing plate by electrophotographic process FUJI PHOTO FILM CO., LTD. (JP) 1997-07-29 US disclosed