⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20860751 | 0.76 | — | — | |
| SCHEMBL13981305 | 0.76 | — | — | |
| SCHEMBL22386210 | 0.74 | — | — | |
| SCHEMBL25809474 | 0.73 | — | — | |
| SCHEMBL16021011 | 0.71 | — | — | |
| SCHEMBL24404184 | 0.70 | — | — | |
| SCHEMBL26515918 | 0.70 | — | — | |
| SCHEMBL6912461 | 0.70 | — | — | |
| SCHEMBL10243336 | 0.67 | — | — | |
| SCHEMBL20902519 | 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-3756464-A1 | SUBSTITUTED OXADIAZOLES FOR COMBATING PHYTOPATHOGENIC FUNGI | BASF SE (DE) | 2020-12-30 | — | — | EP | disclosed |