Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Alcohol. 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 | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | JMJD7 | P0C870 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.53 |
| ▸ | P4HB | P07237 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | SLC10A1 | Q14973 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6754929 | 0.78 | KDM4E (0.69) | KDM4EHTTNPSR1L3MBTL1TP53 | |
| SCHEMBL6420641 | 0.78 | KDM4E (0.69) | KDM4EHTTNPSR1L3MBTL1TP53 | |
| Alcohol SCHEMBL11701443 | 0.76 | KMT2A (0.59) | KDM4EHTTL3MBTL1TP53CYP2C19 | |
| SCHEMBL5981398 | 0.75 | KDM4E (0.56) | KDM4EHTTNPSR1L3MBTL1CYP2D6 | |
| SCHEMBL10594962 | 0.75 | KDM4E (0.56) | KDM4EHTTNPSR1L3MBTL1CYP2D6 | |
| SCHEMBL7469247 | 0.75 | CCNA2 (0.51) | KDM4EHTTNPSR1L3MBTL1CYP2D6 | |
| SCHEMBL7469257 | 0.75 | CCNA2 (0.51) | KDM4EHTTNPSR1L3MBTL1CYP2D6 | |
| Alcohol SCHEMBL27545431 | 0.74 | GAA (0.50) | HTTTP53CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL7465452 | 0.74 | FDPS (0.50) | KDM4EHTTNPSR1L3MBTL1CYP2D6 | |
| SCHEMBL4969090 | 0.74 | FDPS (0.50) | KDM4EHTTNPSR1L3MBTL1CYP2D6 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2580198-B1 | THERMOLABILE 2-(N-2-PYRIDIYL-N-BENZYL)-AMINOETHYLOXYCARBONYL DERIVATIVES AS HYDROXYL FUNCTION PROTECTING AGENTS | INST CHEMII BIOORG POLSKIEJ AKADEMII NAUK (PL) | 2016-08-10 | — | — | EP | disclosed |
| US-8759509-B2 | Way of using thermolabile groups to protect hydroxyl functions and compounds for implementing the procedure | INSTYTUT CHEMII BIOORGANICZNEJ POLSKIEJ AKADEMII NAUK (PL) | 2014-06-24 | — | — | US | disclosed |
| EP-2580198-A1 | THERMOLABILE 2 - (N- 2 - PYRIDIYL - N- BENZYL) - AMINOETHYLOXYCARBONYL DERIVATIVES AS HYDROXYL FUNCTION PROTECTING AGENTS | Instytut Chemii Bioorganicznej Polskiej Akademii Nauk (PL) | 2013-04-17 | — | — | EP | disclosed |
| US-20130085272-A1 | NEW WAY OF USING THERMOLABILE GROUPS TO PROTECT HYDROXYL FUNCTIONS, AND NEW COMPOUNDS FOR IMPLEMENTING THE PROCEDURE | INSTYTUT CHEMII BIOORGANICZNEJ POLSKIEJ AKADEMII NAUK (PL) | 2013-04-04 | — | — | US | disclosed |
| WO-2011155855-A1 | THERMOLABILE 2 - (N- 2 - PYRIDIYL - N- BENZYL) - AMINOETHYLOXYCARBONYL DERIVATIVES AS HYDROXYL FUNCTION PROTECTING AGENTS | INSTYTUT CHEMII BIOORGANICZNEJ POLSKIEJ AKADEMII NAUK (PL) | 2011-12-15 | — | — | 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-20130085272-A1 | NEW WAY OF USING THERMOLABILE GROUPS TO PROTECT HYDROXYL FUNCTIONS, AND NEW COMPOUNDS FOR IMPLEMENTING THE PROCEDURE | RNGTT, POLB, UNG | KDM4E 3332/4885HTT 784/4885NPSR1 1955/4885 |
“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.