⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19667940 | 1.00 | — | — | |
| SCHEMBL4386057 | 0.69 | — | — | |
| SCHEMBL4386054 | 0.69 | — | — | |
| SCHEMBL5709669 | 0.69 | — | — | |
| SCHEMBL15739022 | 0.67 | — | — | |
| SCHEMBL12143376 | 0.67 | — | — | |
| SCHEMBL11010702 | 0.60 | — | — | |
| SCHEMBL40167 | 0.59 | — | — | |
| SCHEMBL6337059 | 0.59 | — | — | |
| Methyl Alcohol SCHEMBL4870551 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5616654-A | Polyolefin diols | BP CHEMICALS LIMITED (GB) | 1997-04-01 | — | — | US | disclosed |
| US-5585444-A | Polylefin diols | BP CHEMICALS LIMITED (GB) | 1996-12-17 | — | — | US | disclosed |
| EP-0737662-A2 | Polyolefin diols | BP Chemicals Limited (GB) | 1996-10-16 | — | — | EP | disclosed |