⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14430844 | 0.74 | — | — | |
| SCHEMBL25951929 | 0.73 | — | — | |
| SCHEMBL24850106 | 0.72 | — | — | |
| SCHEMBL11490210 | 0.71 | — | — | |
| SCHEMBL25097368 | 0.71 | — | — | |
| SCHEMBL7777049 | 0.69 | — | — | |
| SCHEMBL28100527 | 0.68 | — | — | |
| SCHEMBL28100526 | 0.68 | — | — | |
| SCHEMBL21517307 | 0.67 | — | — | |
| SCHEMBL15540928 | 0.67 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |
| 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 |