⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22196940 | 0.79 | — | — | |
| SCHEMBL18569915 | 0.72 | — | — | |
| SCHEMBL8007666 | 0.69 | — | — | |
| SCHEMBL8173264 | 0.69 | — | — | |
| SCHEMBL14671677 | 0.67 | ADH1B (0.31) | — | |
| SCHEMBL19359597 | 0.65 | — | — | |
| SCHEMBL20183936 | 0.65 | — | — | |
| SCHEMBL19792366 | 0.65 | — | — | |
| SCHEMBL1786208 | 0.65 | — | — | |
| SCHEMBL1786206 | 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-1731512-B9 | ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND NOXIOUS ORGANISM CONTROL AGENT | NISSAN CHEMICAL IND LTD (JP) | 2017-03-01 | — | — | EP | disclosed |