⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL5837644 | 0.91 | — | — | |
| SCHEMBL5837492 | 0.91 | — | — | |
| SCHEMBL21185617 | 0.87 | SI (0.31) | — | |
| SCHEMBL18662522 | 0.87 | SI (0.31) | — | |
| SCHEMBL18662508 | 0.84 | SI (0.30) | — | |
| SCHEMBL5837037 | 0.84 | — | — | |
| SCHEMBL12429959 | 0.82 | — | — | |
| SCHEMBL5837996 | 0.81 | — | — | |
| SCHEMBL5837150 | 0.81 | — | — | |
| SCHEMBL29321393 | 0.80 | SI (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7074304-B2 | Process for purifying alicyclic alcohols | CELANESE CHEMICALS EUROPE GMBH (DE) | 2006-07-11 | — | — | US | claimed |
| EP-1319645-B1 | Process for the purification of alicyclic alcohols | CELANESE CHEM EUROPE GMBH (DE) | 2005-10-26 | — | — | EP | claimed |
| EP-1319645-A2 | Process for the purification of alicyclic alcohols | Celanese Chemicals Europe GmbH (DE) | 2003-06-18 | — | — | EP | claimed |
| US-7074304-B2 | Process for purifying alicyclic alcohols | CELANESE CHEMICALS EUROPE GMBH (DE) | 2006-07-11 | — | — | US | disclosed |
| EP-1319645-B1 | Process for the purification of alicyclic alcohols | CELANESE CHEM EUROPE GMBH (DE) | 2005-10-26 | — | — | EP | disclosed |
| US-20030183502-A1 | Process for purifying alicyclic alcohols | DRACHENFELSSEE 521. VV GMBH (TO BE RENAMED OXEA DEUTSCHLAND GMBH) (DE) | 2003-10-02 | — | — | US | disclosed |
| EP-1319645-A2 | Process for the purification of alicyclic alcohols | Celanese Chemicals Europe GmbH (DE) | 2003-06-18 | — | — | EP | disclosed |