⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19024201 | 0.73 | — | — | |
| SCHEMBL32664263 | 0.73 | — | — | |
| SCHEMBL32664219 | 0.73 | — | — | |
| SCHEMBL20676147 | 0.72 | ALPL (0.39) | — | |
| SCHEMBL25145098 | 0.69 | — | — | |
| SCHEMBL20931137 | 0.69 | — | — | |
| SCHEMBL2388450 | 0.67 | — | — | |
| SCHEMBL19195070 | 0.67 | ALPL (0.36) | — | |
| SCHEMBL12262720 | 0.67 | — | — | |
| SCHEMBL2390138 | 0.67 | — | — |
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-106458985-B | 6-heteroaryloxy-and 6-aryloxy-quinoline-2-carboxamides and their use | 艾伯维公司 | 2019-05-03 | — | — | CN | disclosed |