⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6205206 | 0.93 | — | — | |
| SCHEMBL2837079 | 0.87 | PDK2 (0.32) | — | |
| SCHEMBL6204817 | 0.85 | NOTUM (0.31) | — | |
| SCHEMBL6205437 | 0.83 | DHODH (0.31) | — | |
| SCHEMBL2832299 | 0.82 | — | — | |
| SCHEMBL2836864 | 0.82 | RECQL (0.36) | — | |
| SCHEMBL2836086 | 0.79 | PDK2 (0.33) | — | |
| SCHEMBL1573684 | 0.79 | — | — | |
| SCHEMBL10576855 | 0.77 | BCAT1 (0.34) | — | |
| SCHEMBL10574787 | 0.76 | ADORA3 (0.33) | — |
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-1585737-A2 | URACILS HAVING A HERBICIDAL ACTIVITY | Isagro Ricerca S.r.l. (IT) | 2005-10-19 | — | — | EP | disclosed |
| WO-2004056785-A2 | URACILS HAVING A HERBICIDAL ACTIVITY | ISAGRO RICERCA S.R.L. (IT) | 2004-07-08 | — | — | WO | disclosed |