⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1069448 | 0.78 | — | — | |
| SCHEMBL15062536 | 0.74 | — | — | |
| SCHEMBL6151310 | 0.73 | — | — | |
| SCHEMBL4629913 | 0.73 | — | — | |
| SCHEMBL284612 | 0.72 | — | — | |
| SCHEMBL22837 | 0.72 | — | — | |
| SCHEMBL28235810 | 0.72 | — | — | |
| Methyl Alcohol SCHEMBL28295123 | 0.69 | — | — | |
| Alcohol SCHEMBL28287486 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL20163989 | 0.67 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0311766-B1 | PREPARATION AND USE OF MIXTURES WITH A HIGH CONTENT OF CYCLOSILOXANES | WACKER-CHEMIE GMBH (DE) | 1991-10-30 | — | — | EP | disclosed |
| US-4888405-A | Preparation and processing of mixtures containers organocyclosiloxanes | WACKER-CHEMIE GMBH (DE) | 1989-12-19 | — | — | US | disclosed |
| EP-0311766-A2 | Preparation and use of mixtures with a high content of cyclosiloxanes | WACKER-CHEMIE GMBH (DE) | 1989-04-19 | — | — | EP | disclosed |