⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27641109 | 0.72 | — | — | |
| SCHEMBL1277046 | 0.67 | — | — | |
| SCHEMBL730714 | 0.64 | — | — | |
| SCHEMBL4661726 | 0.62 | — | — | |
| SCHEMBL30940538 | 0.62 | — | — | |
| Hydrochloric Acid SCHEMBL9393513 | 0.62 | — | — | |
| Water SCHEMBL27523845 | 0.62 | — | — | |
| SCHEMBL14848253 | 0.60 | — | — | |
| SCHEMBL18406997 | 0.60 | — | — | |
| SCHEMBL27592364 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1747951-A | Novel 2-pyridinecarboxamide derivatives | BANYU PHARMA CO LTD (JP) | 2006-03-15 | — | — | CN | disclosed |