⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1421273 | 0.98 | STAT3 (0.30) | — | |
| SCHEMBL15687364 | 0.98 | STAT3 (0.30) | — | |
| SCHEMBL6945728 | 0.87 | — | — | |
| SCHEMBL6939829 | 0.86 | ALOX5 (0.32) | — | |
| SCHEMBL6943401 | 0.85 | — | — | |
| SCHEMBL15687558 | 0.85 | ALOX5 (0.34) | — | |
| SCHEMBL15687540 | 0.85 | ALOX5 (0.34) | — | |
| SCHEMBL6138334 | 0.83 | ACHE (0.44) | — | |
| SCHEMBL15687665 | 0.83 | ACHE (0.44) | — | |
| SCHEMBL4416086 | 0.83 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014071457-A1 | DUAL ACTION NITRIC OXIDE DONORS AND THEIR USE AS ANTIMICROBIAL AGENTS | NEWSOUTH INNOVATIONS PTY LIMITED (AU) | 2014-05-15 | — | — | WO | disclosed |
| EP-2024113-A1 | ANTIMICROBIAL COATINGS | Tyco Healthcare Group LP (US) | 2009-02-18 | — | — | EP | disclosed |
| WO-2007133782-A1 | ANTIMICROBIAL COATINGS | TYCO HEALTHCARE GROUP LP (US) | 2007-11-22 | — | — | WO | disclosed |
| 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 |