⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3057322 | 1.00 | — | — | |
| SCHEMBL10309616 | 0.77 | — | — | |
| SCHEMBL3634166 | 0.65 | — | — | |
| SCHEMBL10309593 | 0.65 | — | — | |
| SCHEMBL8415754 | 0.65 | — | — | |
| SCHEMBL12477162 | 0.63 | — | — | |
| SCHEMBL760396 | 0.61 | TP53 (0.30) | — | |
| SCHEMBL21913789 | 0.59 | — | — | |
| SCHEMBL1031677 | 0.59 | — | — | |
| SCHEMBL1031675 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8076487-B2 | Pyridone derivative and herbicide | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2011-12-13 | — | — | US | disclosed |
| US-20100222592-A1 | Pyridone Derivative and Herbicide | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2010-09-02 | — | — | US | disclosed |