⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6415619 | 1.00 | — | — | |
| SCHEMBL6415191 | 0.73 | — | — | |
| SCHEMBL6415189 | 0.73 | — | — | |
| SCHEMBL7732020 | 0.71 | — | — | |
| SCHEMBL7732016 | 0.71 | — | — | |
| SCHEMBL6415176 | 0.69 | — | — | |
| SCHEMBL7723806 | 0.69 | — | — | |
| SCHEMBL7723807 | 0.69 | — | — | |
| SCHEMBL7732010 | 0.69 | — | — | |
| SCHEMBL7732012 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20050066453-A1 | Photochromic dye | NEW PRISMATIC ENTERPRISE CO., LTD. (TW) | 2005-03-31 | — | — | US | disclosed |
| EP-1115711-B1 | REGIOSELECTIVE FLUORINATION OF PHENYL-SUBSTITUTED TRIAZOLINONES | FMC CORP (US) | 2003-06-04 | — | — | EP | disclosed |
| US-6407041-B1 | HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2002-06-18 | — | — | US | disclosed |
| EP-1115711-A1 | REGIOSELECTIVE FLUORINATION OF PHENYL-SUBSTITUTED TRIAZOLINONES | FMC CORPORATION (US) | 2001-07-18 | — | — | EP | disclosed |
| US-6218545-B1 | Regioselective fluorination of phenyl-substituted triazolinones | FMC CORPORATION | 2001-04-17 | — | — | US | disclosed |
| WO-2000012490-A1 | REGIOSELECTIVE FLUORINATION OF PHENYL-SUBSTITUTED TRIAZOLINONES | FMC CORPORATION (US) | 2000-03-09 | — | — | WO | disclosed |