Ethyl Acetate

Ethyl Acetate

SCHEMBL3201904

CCOC(C)=O.ClC(Cl)C1CCCCC1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
LMNA P02545 1/20 0.50
HSD17B10 Q99714 1/20 0.50
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
THRB P10828 1/20 0.41
ATM Q13315 1/20 0.41
TSHR P16473 3/20 0.41
KDM4E B2RXH2 2/20 0.36
SHBG P04278 1/20 0.36
POLB P06746 1/20 0.35
EPHX1 P07099 1/20 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
SCHEMBL11075254 0.83 L3MBTL1 (0.42) ALDH1A1LMNANPSR1L3MBTL1THRB
Cyclohexane SCHEMBL6438104 0.82 ALDH1A1 (0.67) ALDH1A1LMNAHSD17B10L3MBTL1THRB
Cyclohexane SCHEMBL8362005 0.81 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10L3MBTL1THRB
Cyclohexane SCHEMBL27782650 0.79 ALDH1A1 (0.61) ALDH1A1LMNAHSD17B10L3MBTL1THRB
Biphenyl SCHEMBL28087429 0.79 ALDH1A1 (0.61) ALDH1A1LMNAHSD17B10NPSR1L3MBTL1
Cyclohexane SCHEMBL855765 0.78 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10L3MBTL1THRB
Cyclohexane SCHEMBL416739 0.78 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10L3MBTL1THRB
Cyclohexane SCHEMBL5908851 0.78 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10L3MBTL1THRB
Cyclohexane SCHEMBL15635357 0.78 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10L3MBTL1THRB
Cyclohexane SCHEMBL509553 0.78 ALDH1A1 (0.82) ALDH1A1LMNAHSD17B10L3MBTL1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9309179-B2 Hydroxyphenyl derivatives and biological applications thereof FAB PHARMA (FR) 2016-04-12 US disclosed
US-20140213589-A1 HYDROXYPHENYL DERIVATIVES AND BIOLOGICAL APPLICATIONS THEREOF FAB PHARMA S.A.S. (FR) 2014-07-31 US disclosed
US-8722746-B2 Hydroxyphenyl derivatives and biological applications thereof FAB PHARMA S.A.S. (FR) 2014-05-13 US disclosed
US-8513250-B2 Imidazolo-heteroaryl derivatives with antibacterial properties LABORATOIRE BIODIM (FR) 2013-08-20 US disclosed
US-8227511-B2 Substituted chromanol derivatives and their use BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-07-24 US disclosed
US-20100130489-A1 IMIDAZOLO-HETEROARYL DERIVATIVES WITH ANTIBACTERIAL PROPERTIES MUTABILIS SA (FR) 2010-05-27 US disclosed
US-20100041658-A1 Hydroxyphenyl Derivatives and Biological Applications Thereof FAB PHARMA (FR) 2010-02-18 US disclosed
US-20090306197-A1 Substituted Chromanol Derivatives and Their Use BAYER HEALTHCARE AG (DE) 2009-12-10 US disclosed
US-7078414-B2 Derivatives of 3-guanidinocarbonyl-1-heteroaryl-pyrrole, preparation process and intermediates of this process, their use as medicaments, and pharmaceutical compositions comprising them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-07-18 US disclosed
US-6900194-B1 Use of substituted 4-biarylbutyric and 5-biarylpentanoic acid derivatives as matrix metalloprotease inhibitors for the treatment of respiratory diseases BAYER AKTIENGESELLSCHAFT (DE) 2005-05-31 US disclosed
EP-1523480-A2 DERIVATIVES OF 3-GUANIDINOCARBONYL-1-HETEROARYL-PYRROLE, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE Aventis Pharma Deutschland GmbH (DE) 2005-04-20 EP disclosed
US-20040266775-A1 Derivatives of 3-guanidinocarbonyl-1-heteroaryl-pyrrole, preparation process and intermediates of this process, their use as medicaments, and pharmaceutical compositions comprising them AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-12-30 US disclosed
WO-2004007478-A2 DERIVATIVES OF 3-GUANIDINOCARBONYL-1-HETEROARYL-PYRROLE, PROCESS FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL USE AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-01-22 WO disclosed
EP-1110552-A1 Use of a compound with affinity for the mitochondrial benzodiazepine receptor in cancer therapy Aventis Pharma S.A. (FR) 2001-06-27 EP disclosed
US-5385931-A Multistage formation of sulfonamides by reaction of esters and acyl halides, nitriding, reduction and sulfonylation to form cardiovascular compounds PIERRE FABRE MEDICAMENT (FR) 1995-01-31 US disclosed
US-4479966-A 6,9-Methano-PGI2 analogues ONO PHARMACEUTICAL COMPANY, LTD. (JP) 1984-10-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090306197-A1 Substituted Chromanol Derivatives and Their Use CYP46A1, CBX3, CDYL ALDH1A1 1180/4885LMNA 98/4885HSD17B10 424/4885
US-20140213589-A1 HYDROXYPHENYL DERIVATIVES AND BIOLOGICAL APPLICATIONS THEREOF HPD, HPGDS, EPX ALDH1A1 171/4885LMNA 3256/4885HSD17B10 165/4885
US-20100130489-A1 IMIDAZOLO-HETEROARYL DERIVATIVES WITH ANTIBACTERIAL PROPERTIES DLAT, DLST, DNTT ALDH1A1 1002/4885LMNA 4169/4885HSD17B10 456/4885
US-20100041658-A1 Hydroxyphenyl Derivatives and Biological Applications Thereof HPD, HPGDS, EPX ALDH1A1 171/4885LMNA 3256/4885HSD17B10 165/4885
US-20040266775-A1 Derivatives of 3-guanidinocarbonyl-1-heteroaryl-pyrrole, preparation process and intermediates of this process, their use as medicaments, and pharmaceutical compositions comprising them GPBAR1, ADRB3, ADRA1A ALDH1A1 266/4885LMNA 1140/4885HSD17B10 1506/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.