⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2016806 | 0.81 | — | — | |
| SCHEMBL1148747 | 0.69 | — | — | |
| SCHEMBL20511468 | 0.69 | — | — | |
| SCHEMBL10819074 | 0.67 | — | — | |
| SCHEMBL917482 | 0.67 | — | — | |
| SCHEMBL3695974 | 0.67 | — | — | |
| SCHEMBL18284611 | 0.67 | — | — | |
| SCHEMBL22804028 | 0.67 | — | — | |
| SCHEMBL1679931 | 0.67 | — | — | |
| SCHEMBL12454171 | 0.63 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2509959-A1 | AZOLE DERIVATIVES AND METHODS FOR PRODUCING THE SAME, INTERMEDIATE COMPOUNDS FOR THE DERIVATIVES AND METHODS FOR PRODUCING THE SAME, AND AGRO-HORTICULTURAL AGENTS AND INDUSTRIAL MATERIAL PROTECTING AGENTS CONTAINING THE DERIVATIVES | Kureha Corporation (JP) | 2012-10-17 | — | — | EP | disclosed |
| US-20120238762-A1 | AZOLE DERIVATIVES AND METHODS FOR PRODUCING THE SAME, INTERMEDIATE COMPOUNDS FOR THE DERIVATIVES AND METHODS FOR PRODUCING THE SAME, AND AGRO-HORTICULTURAL AGENTS AND INDUSTRIAL MATERIAL PROTECTING AGENTS CONTAINING THE DERIVATIVES | KUREHA CORPORATION (JP) | 2012-09-20 | — | — | US | disclosed |
| CN-102639508-A | Azole derivatives and methods for producing the same, intermediate compounds for the derivatives and methods for producing the same, and agro-horticultural agents and industrial material protecting agents containing the derivatives | KUREHA CORP | 2012-08-15 | — | — | CN | disclosed |
| WO-2011070742-A1 | AZOLE DERIVATIVES AND METHODS FOR PRODUCING THE SAME, INTERMEDIATE COMPOUNDS FOR THE DERIVATIVES AND METHODS FOR PRODUCING THE SAME, AND AGRO-HORTICULTURAL AGENTS AND INDUSTRIAL MATERIAL PROTECTING AGENTS CONTAINING THE DERIVATIVES | KUREHA CORPORATION (JP) | 2011-06-16 | — | — | WO | disclosed |