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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1698570 | 0.92 | — | — | |
| SCHEMBL1698442 | 0.92 | — | — | |
| SCHEMBL321670 | 0.92 | — | — | |
| Methyl Alcohol SCHEMBL28090165 | 0.90 | ALDH1A1 (0.49) | ALDH1A1HPGDKMT2ALMNAPOLB | |
| Water SCHEMBL28237304 | 0.90 | ALDH1A1 (0.51) | ALDH1A1HPGDKMT2ALMNAPOLB | |
| Hydrochloric Acid SCHEMBL3538913 | 0.90 | ALDH1A1 (0.51) | ALDH1A1HPGDKMT2ALMNAPOLB | |
| Isopropyl Alcohol SCHEMBL6535848 | 0.87 | ALDH1A1 (0.46) | ALDH1A1HPGDKMT2ALMNAPOLB | |
| Methylene Chloride SCHEMBL7294170 | 0.86 | ALDH1A1 (0.49) | ALDH1A1HPGDKMT2ALMNAPOLB | |
| SCHEMBL12080775 | 0.86 | ALDH1A1 (0.47) | ALDH1A1HPGDKMT2ALMNAPOLB | |
| SCHEMBL12081039 | 0.86 | ALDH1A1 (0.47) | ALDH1A1HPGDKMT2ALMNAPOLB |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7432392-B2 | Ester derivatives and medical use thereof | JAPAN TOBACCO INC. (JP) | 2008-10-07 | — | — | US | disclosed |
| US-20060205726-A1 | Ester derivatives and medical use thereof | JAPAN TOBACCO INC. (JP) | 2006-09-14 | — | — | US | disclosed |
| EP-1669345-A1 | ESTER DERIVATIVE AND MEDICINAL USE THEREOF | JAPAN TOBACCO INC. (JP) | 2006-06-14 | — | — | EP | disclosed |
| US-20030013870-A1 | Carbopeptoids and carbonucleotoids | THE SCRIPPS RESEARCH INSTITUTE (US) | 2003-01-16 | — | — | US | disclosed |
| US-6384211-B1 | LIBRARY OF OLIGOMERIC CARBOPEPTOID COMPOUNDS FOR USE IN DRUG SCREENING; OLIGOMERS HAVE AT LEAST TWO CARBOHYDRATE AMINO ACID SUBUNITS COUPLED TOGETHER BY AN AMIDE LINKAGE | THE SCRIPPS RESEARCH INSTITUTE | 2002-05-07 | — | — | US | disclosed |
| US-6204376-B1 | CARBOPEPTIDES THAT ARE OLIGOSACCHARIDES HAVING CARBOHYDRATE SUBUNITS LINKED BY AMIDE BONDS AND CARBONUCLEOTOIDS THAT ARE OLIGOSACCHARIDES HAVING CARBOHYDRATE SUBUNITS LINKED BY PHOSPHODIESTER BONDS; LIBRARIES | THE SCRIPPS RESEARCH INSTITUTE | 2001-03-20 | — | — | US | disclosed |
| EP-0827406-A4 | — | — | 1998-03-11 | — | — | EP | disclosed |
| EP-0827406-A1 | CARBOPEPTOIDS AND CARBONUCLEOTOIDS | THE SCRIPPS RESEARCH INSTITUTE (US) | 1998-03-11 | — | — | EP | disclosed |
| WO-1996027379-A9 | CARBOPEPTOIDS AND CARBONUCLEOTOIDS | — | 1996-11-28 | — | — | WO | disclosed |
| WO-1996027379-A1 | CARBOPEPTOIDS AND CARBONUCLEOTOIDS | THE SCRIPPS RESEARCH INSTITUTE (US) | 1996-09-12 | — | — | 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 (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-20060205726-A1 | Ester derivatives and medical use thereof | MTTP, LIPC, CETP | ALDH1A1 733/4885HPGD 1045/4885KMT2A 3643/4885 |
| US-20030013870-A1 | Carbopeptoids and carbonucleotoids | RNGTT, NPEPPS, PNP | ALDH1A1 4834/4885HPGD 1045/4885KMT2A 2968/4885 |
“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.