Ethyl Acetate

Ethyl Acetate

SCHEMBL3213147

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

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 3/20 0.44
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 1/20 0.44
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
FAAH O00519 2/20 0.37
HTT P42858 1/20 0.37
THRB P10828 1/20 0.35
PKM P14618 1/20 0.35
CES2 O00748 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
Ethyl Acetate SCHEMBL1970256 0.84 MAPT (0.41) MAPTMEN1KMT2AATML3MBTL1
SCHEMBL15578250 0.83 LMNA (0.36) LMNATHRBCES2
SCHEMBL554730 0.83 LMNA (0.36) LMNATHRBCES2
Ethyl Acetate SCHEMBL13737737 0.78 ALDH1A1 (0.52) MAPTMEN1KMT2AATML3MBTL1
Heptane SCHEMBL1190938 0.77 ALDH1A1 (0.74) MAPTMEN1KMT2AATML3MBTL1
Heptane SCHEMBL276236 0.77 ALDH1A1 (0.74) MAPTMEN1KMT2AATML3MBTL1
Heptane SCHEMBL2399914 0.77 ALDH1A1 (0.74) MAPTMEN1KMT2AATML3MBTL1
Heptane SCHEMBL1680974 0.77 ALDH1A1 (0.74) MAPTMEN1KMT2AATML3MBTL1
Heptane SCHEMBL15345911 0.77 ALDH1A1 (0.74) MAPTMEN1KMT2AATML3MBTL1
Dodecane SCHEMBL3308504 0.77 ALDH1A1 (0.74) MAPTMEN1KMT2AATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7737166-B2 Antifungal bicyclic hetero ring compounds DAIICHI SANKYO COMPANY, LIMITED (JP) 2010-06-15 US disclosed
US-20100041892-A1 Therapeutic agent for diabetes ABE HIDENORI 2010-02-18 US disclosed
US-20090270631-A1 Therapeutic agent for diabetes ABE HIDENORI 2009-10-29 US disclosed
US-20090143353-A1 such as 2-tert-Butyl-7-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-5-methyl-6-phenyl-1,3-benzoxazole-4-carbonitrile hydrochloride, a 1,6-beta-glucan synthetase inhibitor having potent growth inhibition, used treating a fungal infections; fungicides DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-06-04 US disclosed
EP-1932837-A1 BICYCLO HETEROCYCLIC COMPOUND HAVING ANTIFUNGAL ACTION Daiichi Sankyo Company, Limited (JP) 2008-06-18 EP disclosed
US-20080009530-A1 Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-10 US disclosed
US-20070149570-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-06-28 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-20070149570-A1 Piperidine derivative and use thereof TACR1, OPRL1, TRPV1 MAPT 4514/4885MEN1 1880/4885KMT2A 1629/4885
US-20090270631-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 MAPT 4588/4885MEN1 3927/4885KMT2A 2787/4885
US-20090143353-A1 such as 2-tert-Butyl-7-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]-5-methyl-6-phenyl-1,3-benzoxazole-4-carbonitrile hydrochloride, a 1,6-beta-glucan synthetase inhibitor having potent growth inhibition, used treating a fungal infections; fungicides CTPS1, TPP1, STS MAPT 866/4885MEN1 1642/4885KMT2A 3159/4885
US-20080009530-A1 Therapeutic Agent for Diabetes FABP4, SLC5A1, SLC5A2 MAPT 4612/4885MEN1 3517/4885KMT2A 2989/4885
US-20100041892-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 MAPT 4588/4885MEN1 3927/4885KMT2A 2787/4885

“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.