Ethyl Acetate

Ethyl Acetate

SCHEMBL2295896

CCCCO.CCOC(C)=O.CCOCC

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.58
LMNA P02545 3/20 0.58
HSD17B10 Q99714 2/20 0.58
TSHR P16473 2/20 0.48
CYP4F2 P78329 3/20 0.39
CYP4A11 Q02928 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
FAAH O00519 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ACHE P22303 6/20 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 SCHEMBL11027649 0.94 ALDH1A1 (0.67) ALDH1A1LMNAHSD17B10TSHRCYP4F2
Ethyl Acetate SCHEMBL2264348 0.94 ALDH1A1 (0.67) ALDH1A1LMNAHSD17B10TSHRCYP4F2
Ethyl Acetate SCHEMBL29257732 0.94 ALDH1A1 (0.67) ALDH1A1LMNAHSD17B10TSHRCYP4F2
Ethyl Acetate SCHEMBL27622625 0.91 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10TSHRCYP4F2
Ethyl Acetate SCHEMBL8340468 0.91 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10TSHRCYP4F2
Hexane SCHEMBL5393958 0.91 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10TSHRCYP4F2
Ethyl Acetate SCHEMBL27623309 0.91 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10TSHRCYP4F2
Ethyl Acetate SCHEMBL4336716 0.91 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10TSHRCYP4F2
Ethyl Acetate SCHEMBL4323421 0.91 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10TSHRCYP4F2
Ethyl Acetate SCHEMBL2675053 0.91 ALDH1A1 (0.64) ALDH1A1LMNAHSD17B10TSHRCYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116650580-B Daphne giraldii Nitsche product and preparation method and application thereof 秦皇岛市山海关药业有限责任公司 2024-02-09 CN disclosed
CN-116650580-A Daphne giraldii Nitsche product and preparation method and application thereof 秦皇岛市山海关药业有限责任公司 2023-08-29 CN disclosed
US-20220162209-A1 SALICYL-ADENOSINEMONOSULFAMATE ANALOGS AND USES THEREOF MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2022-05-26 US disclosed
US-7989430-B2 Antibacterial agents REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2011-08-02 US disclosed
US-20080293666-A1 Antibacterial Agents REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2008-11-27 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 (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-20220162209-A1 SALICYL-ADENOSINEMONOSULFAMATE ANALOGS AND USES THEREOF ADSL, SLC35B2, ADORA1 ALDH1A1 136/4885LMNA 3181/4885HSD17B10 3491/4885
US-20080293666-A1 Antibacterial Agents MRPL21, ABCB7, MSR1 ALDH1A1 1972/4885LMNA 2265/4885HSD17B10 2215/4885

“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.