⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10441435 | 0.71 | — | — | |
| SCHEMBL5354811 | 0.71 | — | — | |
| SCHEMBL283272 | 0.71 | — | — | |
| SCHEMBL30096510 | 0.68 | — | — | |
| SCHEMBL10445233 | 0.68 | — | — | |
| SCHEMBL28628348 | 0.68 | — | — | |
| SCHEMBL29050085 | 0.68 | — | — | |
| Isopropyl Alcohol SCHEMBL7043658 | 0.66 | — | — | |
| SCHEMBL7521728 | 0.66 | — | — | |
| SCHEMBL8522405 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110305143-B | Furan [2,3-c ] pyridine derivative and preparation method and application thereof | 济南新科医药科技有限公司 | 2021-03-09 | — | — | CN | disclosed |