Ethyl Acetate

Ethyl Acetate

SCHEMBL3635964

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

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
LMNA P02545 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TSHR P16473 3/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM1 P11229 1/20 0.37
TBXA2R P21731 1/20 0.37
GALR3 O60755 1/20 0.36
MAPT P10636 1/20 0.36
BLM P54132 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 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
SCHEMBL494492 0.97 TSHR (0.39) ALDH1A1LMNAHSD17B10TSHRCHRM2
Ethyl Acetate SCHEMBL5905815 0.92 ALDH1A1 (0.54) ALDH1A1LMNAHSD17B10TSHRCHRM2
Propylene Glycol Diacetate SCHEMBL4196506 0.87 ALDH1A1 (0.35) ALDH1A1LMNAHSD17B10TSHRCHRM2
SCHEMBL4583707 0.87 TSHR (0.33) ALDH1A1LMNAHSD17B10TSHRCHRM2
SCHEMBL15207313 0.83 TSHR (0.41) ALDH1A1HSD17B10TSHRCHRM2CHRM4
SCHEMBL28255060 0.82 TSHR (0.47) ALDH1A1LMNAHSD17B10TSHRCHRM2
Ethyl Acetate SCHEMBL20496512 0.82 ALDH1A1 (0.67) ALDH1A1LMNAHSD17B10TSHR
Propane SCHEMBL9161382 0.80 TSHR (0.48) ALDH1A1LMNAHSD17B10TSHRCHRM2
Isopropyl Alcohol SCHEMBL15345279 0.80 TSHR (0.48) ALDH1A1HSD17B10TSHRCHRM2CHRM4
SCHEMBL23294918 0.80 TSHR (0.52) ALDH1A1LMNAHSD17B10TSHRCHRM2

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
EP-2164648-A1 LOW K DIELECTRIC Sba Materials, Inc. (US) 2010-03-24 EP disclosed
WO-2008156680-A1 LOW K DIELECTRIC SBA MATERIALS, INC. (US) 2008-12-24 WO disclosed