Ethacrynic Acid

Ethacrynic Acid

SCHEMBL905726

C=C(CC)C(=O)c1ccc(OCC(=O)O)c(Cl)c1Cl.[NaH].[NaH]

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC12A1

The experimentally established mechanism targets of Ethacrynic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSTP1 P09211 14/20 0.97
▸ GSTA1 P08263 8/20 0.97
▸ CYP2C9 P11712 2/20 0.97
▸ ALDH1A1 P00352 2/20 0.97
▸ NPSR1 Q6W5P4 2/20 0.97
▸ MEN1 O00255 1/20 0.97
▸ ABCC3 O15438 1/20 0.97
▸ PLIN1 O60240 1/20 0.97
▸ LMNA P02545 1/20 0.97
▸ TP53 P04637 1/20 0.97
▸ MAPT P10636 1/20 0.97
▸ HSPD1 P10809 1/20 0.97
▸ TSHR P16473 1/20 0.97
▸ HTT P42858 1/20 0.97
▸ RECQL P46063 1/20 0.97
▸ MAP2K6 P52564 1/20 0.97
▸ HSPE1 P61604 1/20 0.97
▸ GSTO1 P78417 1/20 0.97
▸ PLIN5 Q00G26 1/20 0.97
▸ KMT2A Q03164 1/20 0.97

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
Ethacrynic Acid SCHEMBL2482896 1.00 GSTP1 (0.97) GSTP1GSTA1CYP2C9ALDH1A1NPSR1
Ethacrynic Acid SCHEMBL9108011 0.99 GSTP1 (1.00) GSTP1GSTA1CYP2C9ALDH1A1NPSR1
Ethacrynic Acid SCHEMBL26353 0.99 GSTP1 (1.00) GSTP1GSTA1CYP2C9ALDH1A1NPSR1
Ethacrynic Acid SCHEMBL29384243 0.99 GSTP1 (1.00) GSTP1GSTA1CYP2C9ALDH1A1NPSR1
Ethacrynic Acid SCHEMBL3713733 0.97 GSTP1 (0.97) GSTP1GSTA1CYP2C9ALDH1A1NPSR1
Ethacrynic Acid SCHEMBL8907134 0.93 GSTP1 (0.84) GSTP1GSTA1CYP2C9ALDH1A1NPSR1
Ethacrynic Acid SCHEMBL18263238 0.91 GSTP1 (0.86) GSTP1GSTA1CYP2C9ALDH1A1NPSR1
SCHEMBL10543330 0.88 GSTP1 (0.81) GSTP1GSTA1CYP2C9ALDH1A1NPSR1
SCHEMBL10001217 0.88 GSTP1 (0.81) GSTP1GSTA1CYP2C9ALDH1A1NPSR1
SCHEMBL9717560 0.88 GSTP1 (0.80) GSTP1GSTA1CYP2C9ALDH1A1NPSR1

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 397 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2277520-A2 A pharmaceutical composition for angiotensin ii-mediated diseases Takeda Pharmaceutical Company Limited (JP) 2011-01-26 — — EP claimed
EP-1844774-A2 A pharmaceutical composition for angiotensin II-mediated diseases Takeda Pharmaceutical Company Limited (JP) 2007-10-17 — — EP claimed
EP-1306089-A1 Combination of benzimidazoles having angiotensin-II antagonistic activity with diuretics or calcium antagonists Takeda Chemical Industries, Ltd. (JP) 2003-05-02 — — EP claimed
EP-1306088-A1 Combination of a benzimidazole having angiotensin-II antagonistic activity with a diuretic Takeda Chemical Industries, Ltd. (JP) 2003-05-02 — — EP claimed
US-20010011098-A1 Pharmaceutical composition for angiotensin II-mediated diseases TAKEDA PHARMACEUTICAL COMPANY, LIMITED (JP) 2001-08-02 — — US claimed
US-20010004640-A1 Pharmaceutical composition for angiotensin II-mediated diseases TAKEDA PHARMACEUTICAL COMPANY, LIMITED (JP) 2001-06-21 — — US claimed
EP-0617001-B1 Phenoxyphenylacetic acid derivatives MERCK & CO INC (US) 2000-01-26 — — EP claimed
EP-0753301-A1 Combination of benzimidazoles having angiotensin-II antagonistic activity with diuretics TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-01-15 — — EP claimed
US-5538991-A TREATMENT OF HYPERTENSION, CARDIOVASCULAR DISORDERS, PROSTATE HYPERPLASIA OR ANTIINFLAMMATORY AGENTS MERCK & CO., INC. (US) 1996-07-23 — — US claimed
WO-1996008486-A1 ENDOTHELIN ANTAGONISTS BEARING 5-MEMBERED HETEROCYCLIC AMIDES MERCK & CO., INC. (US) 1996-03-21 — — WO claimed
EP-0156318-A2 C-terminal amide cyclic renin inhibitors containing peptide isosteres MERCK & CO. INC. (US) 1985-10-02 — — EP claimed
EP-0156322-A2 Renin inhibitors containing peptide isosteres MERCK & CO. INC. (US) 1985-10-02 — — EP claimed
EP-0032725-B1 NOVEL ALDEHYDE ADDUCTS OF TRIAMTERENE AND A PHARMACEUTICAL COMPOSITION CONTAINING THE SAME MERCK & CO. INC. (US) 1985-05-08 — — EP claimed
EP-0129189-A2 Renin inhibitors containing a C-terminal amide cycle and compositions and combinations containing the same MERCK & CO. INC. (US) 1984-12-27 — — EP claimed
US-4472380-A CARBOXYALKYL DIPEPTIDE DERIVATIVES MERCK & CO., INC. (US) 1984-09-18 — — US claimed
EP-0107095-A1 1-N-alkylcarboxy-benzofused lactams useful as antihypertensive agents MERCK & CO. INC. (US) 1984-05-02 — — EP claimed
EP-0081094-A1 Substituted omega-amino-carboxymethyldipeptide antihypertensive agents MERCK & CO. INC. (US) 1983-06-15 — — EP claimed
EP-0079522-A1 N-Carboxymethyl(amidino)lysyl-proline antihypertensive agents MERCK & CO. INC. (US) 1983-05-25 — — EP claimed
US-4285947-A DIURETICS, HYPOTENSIVES INTERX RESEARCH CORPORATION (US) 1981-08-25 — — US claimed
EP-0032725-A1 Novel aldehyde adducts of triamterene and a pharmaceutical composition containing the same MERCK & CO. INC. (US) 1981-07-29 — — EP claimed

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-20010011098-A1 Pharmaceutical composition for angiotensin II-mediated diseases AGTR1, REN, AGTR2 GSTP1 1714/4885GSTA1 1541/4885CYP2C9 1492/4885
US-20010004640-A1 Pharmaceutical composition for angiotensin II-mediated diseases AGTR1, REN, AGTR2 GSTP1 1714/4885GSTA1 1541/4885CYP2C9 1492/4885

“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.

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