Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of 2-Ethylhexanoic 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)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 7/20 | 0.80 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.80 |
| ▸ | CA1 | P00915 | 4/20 | 0.55 |
| ▸ | SLC1A2 | P43004 | 3/20 | 0.52 |
| ▸ | SLC1A1 | P43005 | 3/20 | 0.52 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Diethylamine SCHEMBL28327490 | 0.90 | CA2 (0.63) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL5512393 | 0.89 | CA2 (1.00) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL282014 | 0.89 | CA2 (1.00) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL301319 | 0.89 | CA2 (1.00) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL5695779 | 0.89 | CA2 (1.00) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL8387406 | 0.89 | CA2 (1.00) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL25800 | 0.89 | CA2 (1.00) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL8375903 | 0.89 | CA2 (1.00) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL6121661 | 0.89 | CA2 (1.00) | CA2MAPK1CA1SLC1A2SLC1A1 | |
| 2-Ethylhexanoic Acid SCHEMBL25318625 | 0.87 | CA2 (0.95) | CA2MAPK1CA1SLC1A2SLC1A1 |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11851392-B2 | Self-condensation of aldehydes | EASTMAN CHEMICAL COMPANY (US) | 2023-12-26 | — | — | US | claimed |
| EP-3880640-A1 | SELF-CONDENSATION OF ALDEHYDES | Eastman Chemical Company (US) | 2021-09-22 | — | — | EP | claimed |
| CN-112955423-A | Self-condensation of aldehydes | 伊士曼化工公司 | 2021-06-11 | — | — | CN | claimed |
| WO-2020101902-A1 | SELF-CONDENSATION OF ALDEHYDES | EASTMAN CHEMICAL COMPANY (US) | 2020-05-22 | — | — | WO | claimed |
| JP-9052934-A | — | — | None | — | — | JP | disclosed |
| US-11851392-B2 | Self-condensation of aldehydes | EASTMAN CHEMICAL COMPANY (US) | 2023-12-26 | — | — | US | disclosed |
| US-20210380508-A1 | SELF-CONDENSATION OF ALDEHYDES | EASTMAN CHEMICAL COMPANY (US) | 2021-12-09 | — | — | US | disclosed |
| EP-3880640-A1 | SELF-CONDENSATION OF ALDEHYDES | Eastman Chemical Company (US) | 2021-09-22 | — | — | EP | disclosed |
| CN-112955423-A | Self-condensation of aldehydes | 伊士曼化工公司 | 2021-06-11 | — | — | CN | disclosed |
| WO-2020101902-A1 | SELF-CONDENSATION OF ALDEHYDES | EASTMAN CHEMICAL COMPANY (US) | 2020-05-22 | — | — | WO | disclosed |
| US-7128976-B2 | Composition for film formation, method of film formation, and silica-based film | JSR CORPORATION (JP) | 2006-10-31 | — | — | US | disclosed |
| US-20030091838-A1 | Composition for film formation, method of film formation, and silica-based film | JSR CORPORATION (JP) | 2003-05-15 | — | — | US | disclosed |
| JP-H0952934-A | MATERIAL FOR FORMING RIGID URETHANE FOAM | TOYODA GOSEI CO LTD | 1997-02-25 | — | — | JP | disclosed |
| JP-H00952934-A | — | — | 0001-01-01 | — | — | JP | 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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-11851392-B2 | Self-condensation of aldehydes | ALKBH2, DBF4, ALKBH3 | CA2 352/4885MAPK1 4256/4885CA1 1070/4885 |
| US-20210380508-A1 | SELF-CONDENSATION OF ALDEHYDES | ALKBH2, DBF4, ALKBH3 | CA2 352/4885MAPK1 4256/4885CA1 1070/4885 |
“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.