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.
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 | |
|---|---|---|---|---|
| Acetone SCHEMBL5828252 | 0.82 | ALDH1A1 (0.60) | — | |
| Acetone SCHEMBL8107245 | 0.82 | ALDH1A1 (0.60) | — | |
| Acetone SCHEMBL391390 | 0.82 | ALDH1A1 (0.60) | — | |
| Acetone SCHEMBL4414746 | 0.82 | ALDH1A1 (0.60) | — | |
| Acetone SCHEMBL153745 | 0.82 | — | — | |
| Acetone SCHEMBL8041533 | 0.82 | ALDH1A1 (0.60) | — | |
| Acetone SCHEMBL4909337 | 0.82 | ALDH1A1 (0.60) | — | |
| Acetone SCHEMBL8041534 | 0.82 | ALDH1A1 (0.60) | — | |
| Acetone SCHEMBL5668865 | 0.82 | ALDH1A1 (0.60) | — | |
| Butanedione SCHEMBL169087 | 0.82 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1551796-A4 | IMPROVED SYNTHETON SYNTHESIS | SK ENERGY AND CHEMICAL INC (US) | 2007-03-14 | — | — | EP | disclosed |
| CN-1688539-A | Improved synthesis method of synthon | SK ENERGY AND CHEMICAL INC (US) | 2005-10-26 | — | — | CN | disclosed |
| EP-1551796-A1 | IMPROVED SYNTHETON SYNTHESIS | SK Energy and Chemical, Inc. (US) | 2005-07-13 | — | — | EP | disclosed |
| WO-2004031131-A1 | IMPROVED SYNTHETON SYNTHESIS | SK ENERGY AND CHEMICAL INC. (US) | 2004-04-15 | — | — | WO | disclosed |