⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6943401 | 0.88 | — | — | |
| SCHEMBL6945728 | 0.83 | — | — | |
| SCHEMBL4416086 | 0.79 | — | — | |
| SCHEMBL4414859 | 0.79 | — | — | |
| SCHEMBL1548523 | 0.79 | ACHE (0.35) | — | |
| SCHEMBL6939829 | 0.79 | ALOX5 (0.32) | — | |
| SCHEMBL2234271 | 0.79 | PIM1 (0.32) | — | |
| SCHEMBL15687665 | 0.76 | ACHE (0.44) | — | |
| SCHEMBL4789896 | 0.73 | TOP2A (0.30) | — | |
| SCHEMBL6135976 | 0.72 | ACHE (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1071677-A4 | PRODUCTION OF FURANONES | UNISEARCH LTD (AU) | 2003-04-02 | — | — | EP | disclosed |
| EP-1071677-A1 | PRODUCTION OF FURANONES | UNISEARCH LIMITED (AU) | 2001-01-31 | — | — | EP | disclosed |
| WO-1999054323-A1 | PRODUCTION OF FURANONES | UNISEARCH LIMITED (AU) | 1999-10-28 | — | — | WO | disclosed |