⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27679002 | 0.65 | — | — | |
| SCHEMBL27322359 | 0.65 | — | — | |
| SCHEMBL6754041 | 0.65 | — | — | |
| SCHEMBL823032 | 0.62 | — | — | |
| SCHEMBL8683953 | 0.62 | — | — | |
| SCHEMBL1994220 | 0.62 | — | — | |
| SCHEMBL4327739 | 0.62 | — | — | |
| SCHEMBL9177697 | 0.62 | TSHR (0.35) | — | |
| SCHEMBL19955410 | 0.61 | — | — | |
| SCHEMBL6201869 | 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-1503994-A1 | SUBSTITUTED (THIOXO)CARBONYLAMINO PHENYL URACILES | Bayer CropScience AG (DE) | 2005-02-09 | — | — | EP | disclosed |
| WO-2003093244-A1 | SUBSTITUTED (THIOXO)CARBONYLAMINO PHENYL URACILES | BAYER CROPSCIENCE AG (DE) | 2003-11-13 | — | — | WO | disclosed |