⚠ 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 | |
|---|---|---|---|---|
| Furan-2(5H)-One SCHEMBL25302 | 0.62 | — | — | |
| SCHEMBL3073551 | 0.62 | — | — | |
| SCHEMBL9638566 | 0.62 | — | — | |
| SCHEMBL761813 | 0.62 | — | — | |
| SCHEMBL13228789 | 0.59 | — | — | |
| SCHEMBL22915707 | 0.57 | STS (0.44) | — | |
| SCHEMBL3909034 | 0.57 | — | — | |
| SCHEMBL1696777 | 0.54 | — | — | |
| SCHEMBL5800702 | 0.54 | — | — | |
| SCHEMBL7509076 | 0.50 | ABCG2 (0.58) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100029668-A1 | NOVEL PYRIDAZINE DERIVATIVES | SYNGENTA CROP PROTECTION, INC. (US) | 2010-02-04 | — | — | US | disclosed |
| EP-2049521-A2 | NOVEL PYRIDAZINE DERIVATIVES | Syngeta Participations AG (CH) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008009405-A2 | NOVEL PYRIDAZINE DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2008-01-24 | — | — | WO | disclosed |