Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 4/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 10/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 10/20 | 0.35 |
| ▸ | TAS1R2 | Q8TE23 | 10/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.30 |
| ▸ | LCK | P06239 | 1/20 | 0.30 |
| ▸ | FYN | P06241 | 1/20 | 0.30 |
| ▸ | ABAT | P80404 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4103547 | 0.73 | IMPDH2 (0.39) | IMPDH2TAS1R3TAS1R1TAS1R2KDM4E | |
| SCHEMBL2971633 | 0.69 | GRIA1 (0.47) | KDM4E | |
| Acetic Acid SCHEMBL28282631 | 0.69 | FFAR3 (0.39) | IMPDH2FFAR3LCKFYN | |
| SCHEMBL1786267 | 0.68 | MEN1 (0.43) | IMPDH2TAS1R3TAS1R1TAS1R2KDM4E | |
| SCHEMBL22931572 | 0.65 | — | — | |
| SCHEMBL6727338 | 0.64 | TAS1R3 (0.47) | TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL503607 | 0.64 | TAS1R3 (0.47) | TAS1R3TAS1R1TAS1R2SMN1; SMN2 | |
| Acetic Acid SCHEMBL28507802 | 0.64 | FFAR3 (0.54) | KDM4ESMN1; SMN2FFAR3LCKFYN | |
| SCHEMBL3273301 | 0.64 | SLC6A2 (0.33) | — | |
| Acetic Acid SCHEMBL27493985 | 0.64 | FFAR3 (0.54) | KDM4ESMN1; SMN2FFAR3LCKFYN |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1213992-C | Preparation of 4-methyl-2, 3,5, 6-tetrafluorobenzyl alcohol | SYNGENTA LTD (GB) | 2005-08-10 | — | — | CN | disclosed |
| US-6894195-B2 | Preparation of 4-methyl-2,3,5,6-tetrafluorobenzyl alcohol | SYNGENTA LIMITED (GB) | 2005-05-17 | — | — | US | disclosed |
| EP-1332125-B1 | PREPARATION OF 4-METHYL-2,3,5,6-TETRAFLUOROBENZYL ALCOHOL | SYNGENTA LTD (GB) | 2004-09-29 | — | — | EP | disclosed |
| CN-1494525-A | Preparation of 4-methyl-2,3,5,6-tetrafluorobenzyl alcohol | — | 2004-05-05 | — | — | CN | disclosed |
| US-20040063993-A1 | Preparation of 4-methyl-2,3,5,6-tetrafluorobenzyl alcohol | SYNGENTA LIMITED (GB) | 2004-04-01 | — | — | US | disclosed |
| EP-1332125-A1 | PREPARATION OF 4-METHYL-2,3,5,6-TETRAFLUOROBENZYL ALCOHOL | Syngenta Limited (GB) | 2003-08-06 | — | — | EP | disclosed |
| WO-2002034707-A1 | PREPARATION OF 4-METHYL-2,3,5,6-TETRAFLUOROBENZYL ALCOHOL | SYNGENTA LIMITED (GB) | 2002-05-02 | — | — | WO | 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 (1 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-20040063993-A1 | Preparation of 4-methyl-2,3,5,6-tetrafluorobenzyl alcohol | METTL14, CYP4F2, METTL3 | IMPDH2 3656/4885TAS1R3 1258/4885TAS1R1 2639/4885 |
“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.