⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14547331 | 0.76 | — | — | |
| SCHEMBL13091385 | 0.75 | — | — | |
| SCHEMBL15064229 | 0.74 | — | — | |
| SCHEMBL15256445 | 0.73 | — | — | |
| SCHEMBL7905013 | 0.73 | — | — | |
| SCHEMBL20663214 | 0.72 | — | — | |
| SCHEMBL20100566 | 0.70 | — | — | |
| SCHEMBL9941959 | 0.69 | — | — | |
| SCHEMBL20903670 | 0.68 | — | — | |
| SCHEMBL18019607 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1028125-B1 | Dipeptide compounds having fungicidal activity and their agronomic use | ISAGRO RICERCA SRL (IT) | 2004-01-28 | — | — | EP | claimed |