⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10054140 | 0.76 | — | — | |
| SCHEMBL4046987 | 0.61 | — | — | |
| SCHEMBL14363754 | 0.59 | — | — | |
| SCHEMBL8688413 | 0.51 | — | — | |
| SCHEMBL12666515 | 0.48 | — | — | |
| SCHEMBL22650411 | 0.47 | — | — | |
| SCHEMBL22006943 | 0.45 | — | — | |
| Hydrochloric Acid SCHEMBL28392789 | 0.45 | — | — | |
| Bromide SCHEMBL28393345 | 0.45 | — | — | |
| SCHEMBL27674906 | 0.44 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020017587-A1 | PYRIDAZINONE DERIVATIVE | 大日本住友製薬株式会社 | 2020-01-23 | — | — | WO | disclosed |