⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7733770 | 1.00 | — | — | |
| SCHEMBL6157113 | 0.69 | — | — | |
| SCHEMBL7734625 | 0.69 | — | — | |
| SCHEMBL7734621 | 0.69 | — | — | |
| SCHEMBL6157111 | 0.69 | — | — | |
| SCHEMBL7733715 | 0.67 | — | — | |
| SCHEMBL7723824 | 0.67 | — | — | |
| SCHEMBL7733720 | 0.67 | — | — | |
| SCHEMBL7723820 | 0.67 | — | — | |
| SCHEMBL7734662 | 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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050209251-A1 | Substituted pyrazolo-pyrimidine-4-ones | BAYER CROPSCIENCE AG (DE) | 2005-09-22 | — | — | US | claimed |
| EP-1504005-A2 | SUBSTITUTED PYRAZOLO-PYRIMIDINE-4-ONES | Bayer CropScience AG (DE) | 2005-02-09 | — | — | EP | claimed |
| WO-2003093269-A2 | SUBSTITUTED PYRAZOLO-PYRIMIDINE-4-ONES | BAYER CROPSCIENCE AG (DE) | 2003-11-13 | — | — | WO | claimed |
| US-20050209251-A1 | Substituted pyrazolo-pyrimidine-4-ones | BAYER CROPSCIENCE AG (DE) | 2005-09-22 | — | — | US | disclosed |
| EP-1504005-A2 | SUBSTITUTED PYRAZOLO-PYRIMIDINE-4-ONES | Bayer CropScience AG (DE) | 2005-02-09 | — | — | EP | disclosed |
| WO-2003093269-A2 | SUBSTITUTED PYRAZOLO-PYRIMIDINE-4-ONES | BAYER CROPSCIENCE AG (DE) | 2003-11-13 | — | — | WO | disclosed |
| US-6407041-B1 | HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2002-06-18 | — | — | US | disclosed |
| WO-2002020487-A1 | SUBSTITUTED 1-ARYL-PYRIDIN-2-(THI)ONES | BAYER AKTIENGESELLSCHAFT (DE) | 2002-03-14 | — | — | WO | disclosed |
| EP-1037882-A1 | SUBSTITUTED 2,4-DIAMINO-1,3,5-TRIAZINES | BAYER AG (DE) | 2000-09-27 | — | — | EP | disclosed |
| WO-1999029677-A1 | SUBSTITUTED 2,4-DIAMINO-1,3,5-TRIAZINES | BAYER AKTIENGESELLSCHAFT (DE) | 1999-06-17 | — | — | WO | disclosed |