Ethyl Acetate

Ethyl Acetate

SCHEMBL4168022

CCCCCCCC(=O)OCC.CCCCCCCC(=O)OCC.CCCCCCCC(=O)OCC.CCCCCCCC(=O)OCC.CCCCCCCC(=O)OCC.CCCCCCCC(=O)OCC.CCCCCCCC(=O)OCC.CCCCCCCC(=O)OCC.CCCCCCCC(=O)OCC.CCCCCCCC(=O)OCC.CCOC(=O)CCCO.CCOC(C)=O.CCOC(C)=O.CCOC(C)=O.CCOC(C)=O.CCOC(C)=O.CCOC(C)=O.CCOC(C)=O.CCOC(C)=O.CCOC(C)=O.CCOC(C)=O

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.56
PRKCA P17252 3/20 0.53
PAM P19021 2/20 0.51
LMNA P02545 3/20 0.50
KDM4E B2RXH2 1/20 0.50
DUSP3 P51452 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TSHR P16473 1/20 0.49
MAPT P10636 1/20 0.49
ALDH1A1 P00352 2/20 0.48
HSD17B10 Q99714 1/20 0.48
PRKCE Q02156 1/20 0.47
PRKCQ Q04759 1/20 0.47
PRKCD Q05655 1/20 0.47
DNM1 Q05193 1/20 0.47
CYP1A2 P05177 1/20 0.47

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 SCHEMBL3483756 0.93 DGKA (0.56) DGKAPRKCAPAMLMNAKDM4E
Ethyl Acetate SCHEMBL3310609 0.93 DGKA (0.56) DGKAPRKCAPAMLMNAKDM4E
Ethyl Acetate SCHEMBL1614072 0.93 DGKA (0.64) DGKAPRKCAPAMLMNAKDM4E
Ethyl Acetate SCHEMBL31373773 0.93 DGKA (0.64) DGKAPRKCAPAMLMNAKDM4E
Ethyl Acetate SCHEMBL756143 0.93 DGKA (0.64) DGKAPRKCAPAMLMNAKDM4E
Ethyl Acetate SCHEMBL1777438 0.93 DGKA (0.64) DGKAPRKCAPAMLMNAKDM4E
Hexane SCHEMBL19611429 0.93 DGKA (0.64) DGKAPRKCAPAMLMNAKDM4E
Ethyl Acetate SCHEMBL11889416 0.91 DGKA (0.62) DGKAPRKCAPAMLMNAKDM4E
Heptane SCHEMBL916291 0.91 DGKA (0.61) DGKAPRKCAPAMLMNAKDM4E
Ethyl Acetate SCHEMBL1238750 0.91 ALDH1A1 (0.58) DGKAPRKCALMNATSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324176-B2 Pyrazole derivatives, medicinal composition containing the same, medicinal use thereof, and intermediate for production thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-12-04 US disclosed
US-7635684-B2 treatment of disease associated with hyperglycemia: diabetes, impaired glucose tolerance, impaired fasting glycemia, diabetic complications or obesity; e.g. -[(4-{3-[N-(Carbamoylmethyl)-N-(methanesulfonyl)amino]-propoxy}-2-methylphenyl)methyl]-3-( beta -D-glucopyranosyloxy)-5-isopropyl-1H-pyrazole KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-12-22 US disclosed
US-20090203633-A1 PYRAZOLE DERIVATIVES, MEDICINAL COMPOSITION CONTAINING THE SAME, MEDICINAL USE THEREOF, AND INTERMEDIATE FOR PRODUCTION THEREOF KISSEI PHARMACEUTICAL CO., LTD (JP) 2009-08-13 US disclosed
CN-100413878-C Pyrazole derivatives, medicinal composition containing the same, medicinal use thereof, and intermediate for production thereof KISSEI PHARMACEUTICAL COMPANY (JP) 2008-08-27 CN disclosed
CN-1744916-A Preventive or remedy for diseases caused by hyperglycemia KISSEI PHARMACEUTICAL (JP) 2006-03-08 CN disclosed
US-20060035844-A1 Preventive or remedy for diseases caused by hyperglycemia KISSEI PHARMACEUTICAL CO., LTD. (JP) 2006-02-16 US disclosed
US-20050272669-A1 Pyrazole derivatives, medicinal composition containing the same, medicinal use thereof, and intermediate for production thereof KISSEI PHARMACEUTICAL CO., LTD. (JP) 2005-12-08 US disclosed
CN-1688597-A Pyrazole derivatives, medicinal composition containing the same, medicinal use thereof, and intermediate for production thereof KISSEI PHARMACEUTICAL COMPANY (JP) 2005-10-26 CN 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 (2 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-20090203633-A1 PYRAZOLE DERIVATIVES, MEDICINAL COMPOSITION CONTAINING THE SAME, MEDICINAL USE THEREOF, AND INTERMEDIATE FOR PRODUCTION THEREOF UGGT1, GCKR, SLC5A1 DGKA 2694/4885PRKCA 1913/4885PAM 2775/4885
US-20050272669-A1 Pyrazole derivatives, medicinal composition containing the same, medicinal use thereof, and intermediate for production thereof UGGT1, GCKR, SLC5A1 DGKA 2694/4885PRKCA 1913/4885PAM 2775/4885

“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.