⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL596776 | 0.70 | — | — | |
| SCHEMBL4680989 | 0.69 | — | — | |
| SCHEMBL6633907 | 0.67 | — | — | |
| SCHEMBL6631227 | 0.67 | — | — | |
| SCHEMBL1547690 | 0.67 | — | — | |
| SCHEMBL4667800 | 0.65 | — | — | |
| SCHEMBL3388506 | 0.62 | — | — | |
| SCHEMBL2095144 | 0.61 | — | — | |
| SCHEMBL1963930 | 0.61 | — | — | |
| SCHEMBL10734069 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1980150-A1 | Fungicidal mixtures based on triazolopyrimidine compounds | BASF SE (DE) | 2008-10-15 | — | — | EP | claimed |
| EP-1980150-A1 | Fungicidal mixtures based on triazolopyrimidine compounds | BASF SE (DE) | 2008-10-15 | — | — | EP | disclosed |