Ethyl Acetate

Ethyl Acetate

SCHEMBL7273324

CCOC(C)=O.CCOC(C)=O.CCOC(C)=O.CCOC(C)=O.CCOC(C)=O.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl.ClCCCl

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.78
LMNA P02545 1/20 0.78
HSD17B10 Q99714 1/20 0.78
TSHR P16473 1/20 0.48
GAA P10253 2/20 0.43
ALOX15 P16050 1/20 0.43
MGAM O43451 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
SOAT1 P35610 1/20 0.43
TRPA1 O75762 1/20 0.40
GLO1 Q04760 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
CHRM5 P08912 2/20 0.37

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 SCHEMBL1802042 1.00 ALDH1A1 (0.78) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL15442905 0.97 ALDH1A1 (0.74) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL1469827 0.92 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL4682323 0.92 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL58573 0.92 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL5971339 0.92 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL5524851 0.92 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL2141424 0.92 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL14743913 0.92 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA
Ethyl Acetate SCHEMBL15636011 0.92 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10TSHRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0302793-B1 Aralkylaminoalkoxyphenyl derivatives, process of preparation and compositions containing the same SANOFI ELF (FR) 1993-12-15 EP disclosed
US-5215988-A Treating angina, hypertension, arrhythmia, cerebral vascular insufficiency SANOFI (FR) 1993-06-01 US disclosed
US-5182291-A Angina pectoris, hypotensive, antiarrhythmia, cerebral vascular insufficiency SANOFI (FR) 1993-01-26 US disclosed
US-5147878-A Hypotensive, antiarrhythmia agents SANOFI (FR) 1992-09-15 US disclosed
US-5039700-A Cardiovascular disorders, antitumor agents SANOFI (FR) 1991-08-13 US disclosed
US-5017579-A Use of aminoalkoxyphenyl derivatives for reducing and/or controlling excessive intraocular pressure SANOFI (FR) 1991-05-21 US disclosed
US-4994474-A Hypotensive agents SANOFI (FR) 1991-02-19 US disclosed
US-4957925-A HYPOTENSIVE AGENTS, ANTIARRHYTHMIA AGENTS, TREATMENT OF ANGINA SANOFI (FR) 1990-09-18 US disclosed
EP-0302792-A2 Alkylaminoalkoxyphenyl derivatives, process of preparation and compositions containing the same SANOFI (FR) 1989-02-08 EP disclosed
EP-0302793-A2 Aralkylaminoalkoxyphenyl derivatives, process of preparation and compositions containing the same ELF SANOFI (FR) 1989-02-08 EP disclosed