⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29939810 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL277386 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL11932972 | 0.71 | — | — | |
| SCHEMBL8542693 | 0.71 | — | — | |
| SCHEMBL14678819 | 0.71 | — | — | |
| SCHEMBL15047767 | 0.71 | — | — | |
| SCHEMBL269701 | 0.69 | — | — | |
| SCHEMBL8343474 | 0.69 | — | — | |
| SCHEMBL12154499 | 0.69 | — | — | |
| SCHEMBL4276539 | 0.69 | — | — |
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-1605758-A1 | HERBICIDAL MIXTURES BASED ON 3-PHENYLURACILS | BASF AKTIENGESELLSCHAFT (DE) | 2005-12-21 | — | — | EP | disclosed |
| WO-2004080183-A1 | HERBICIDAL MIXTURES BASED ON 3-PHENYLURACILS | BASF AKTIENGESELLSCHAFT (DE) | 2004-09-23 | — | — | WO | disclosed |