⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21431207 | 0.77 | — | — | |
| SCHEMBL24847720 | 0.75 | — | — | |
| SCHEMBL1704891 | 0.73 | — | — | |
| SCHEMBL5494090 | 0.69 | — | — | |
| SCHEMBL12948670 | 0.69 | — | — | |
| SCHEMBL7240804 | 0.69 | — | — | |
| SCHEMBL15587132 | 0.69 | — | — | |
| SCHEMBL7578676 | 0.65 | — | — | |
| SCHEMBL18481174 | 0.65 | — | — | |
| SCHEMBL24688775 | 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-3320776-A1 | COMPOSITIONS AND METHODS FOR CONTROLLING FUNGAL AND BACTERIAL DISEASES IN PLANTS | Bayer CropScience LP (US) | 2018-05-16 | — | — | EP | disclosed |