⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3116195 | 0.78 | — | — | |
| SCHEMBL8091228 | 0.76 | — | — | |
| SCHEMBL14814059 | 0.72 | TP53 (0.31) | — | |
| SCHEMBL778668 | 0.71 | — | — | |
| SCHEMBL10535127 | 0.70 | ALDH1A1 (0.35) | — | |
| SCHEMBL9816380 | 0.70 | — | — | |
| SCHEMBL17439565 | 0.69 | — | — | |
| SCHEMBL9816672 | 0.67 | — | — | |
| SCHEMBL776446 | 0.65 | — | — | |
| SCHEMBL28308279 | 0.65 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0882715-B1 | NOVEL N-(UNSUBSTITUTED OR SUBSTITUTED)-4-SUBSTITUTED-6-(UNSUBSTITUTED OR SUBSTITUTED)PHENOXY-2-PYRIDINECARBOXAMIDES OR THIOCARBOXAMIDES, PROCESSES FOR PRODUCING THE SAME, AND HERBICIDES | KUREHA CHEMICAL IND CO LTD (JP) | 2003-04-23 | — | — | EP | disclosed |