⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7237219 | 0.81 | PIK3CD (0.33) | — | |
| SCHEMBL2625903 | 0.79 | PIK3CD (0.43) | — | |
| SCHEMBL12697805 | 0.77 | — | — | |
| SCHEMBL15325440 | 0.77 | — | — | |
| SCHEMBL3436789 | 0.77 | — | — | |
| SCHEMBL13103946 | 0.74 | PIK3CD (0.33) | — | |
| SCHEMBL25818428 | 0.73 | — | — | |
| SCHEMBL24815132 | 0.73 | — | — | |
| SCHEMBL22519807 | 0.73 | — | — | |
| SCHEMBL18225574 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20200315174-A1 | SUBSTITUTED THIOPHENYL URACILS, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS | SYNGENTA CROP PROTECTION AG (CH) | 2020-10-08 | — | — | US | disclosed |