Ethyl Acetate

Ethyl Acetate

SCHEMBL7090484

CCOC(C)=O.CCOCC.COCC(C)O

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
HSD17B10 Q99714 2/20 0.52
LMNA P02545 1/20 0.52
TSHR P16473 2/20 0.48
MAPT P10636 1/20 0.36
CHRM5 P08912 2/20 0.35
CHRM1 P11229 2/20 0.35
CHRM3 P20309 2/20 0.35
PGR P06401 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
HTR1A P08908 1/20 0.35
CHRNB2 P17787 1/20 0.35
TBXA2R P21731 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA7 P36544 1/20 0.35
CHRNA4 P43681 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CHRNA10 Q9GZZ6 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
Ethyl Acetate SCHEMBL1744775 0.94 ALDH1A1 (0.58) ALDH1A1HSD17B10LMNATSHRMAPT
Ethyl Acetate SCHEMBL5905816 0.91 ALDH1A1 (0.54) ALDH1A1HSD17B10LMNATSHRMAPT
Ethyl Acetate SCHEMBL28349798 0.89 ALDH1A1 (0.52) ALDH1A1HSD17B10LMNATSHRMAPT
Ethyl Acetate SCHEMBL5073455 0.89 ALDH1A1 (0.56) ALDH1A1HSD17B10LMNATSHRMAPT
Ether SCHEMBL7090487 0.86 HSD17B10 (0.45) ALDH1A1HSD17B10LMNATSHRMAPT
Ethyl Acetate SCHEMBL152186 0.86 ALDH1A1 (0.58) ALDH1A1HSD17B10LMNATSHRMAPT
Ethyl Acetate SCHEMBL2963031 0.85 ALDH1A1 (0.44) ALDH1A1HSD17B10LMNATSHRMAPT
Ether SCHEMBL242693 0.84 ALDH1A1 (0.50) ALDH1A1HSD17B10LMNATSHRMAPT
Ethyl Acetate SCHEMBL9472667 0.84 ALDH1A1 (0.67) ALDH1A1HSD17B10LMNATSHRCHRM5
Ether SCHEMBL2929809 0.84 HSD17B10 (0.54) ALDH1A1HSD17B10LMNATSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6576397-B2 Digital infrared laser scanning; computer-to-plate; handling in a bright room; alkali soluble polymer having addition polymerizable unsaturated bonds; initiator; water soluble polyvinyl alcohol overcoat FUJI PHOTO FILM CO., LTD. (JP) 2003-06-10 US disclosed
US-20010003643-A1 Precursor, comprising a support having a hydrophilic surface on which a thermal polymerization layer comprising a polymer having addition polymerizable unsaturated bond and a initiator; a water soluble overcoat of polyvinyl alcohol FUJIFILM CORPORATION (JP) 2001-06-14 US disclosed