⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23571131 | 0.75 | — | — | |
| SCHEMBL24033601 | 0.75 | — | — | |
| SCHEMBL24782311 | 0.66 | — | — | |
| SCHEMBL24033602 | 0.66 | — | — | |
| SCHEMBL22130879 | 0.65 | — | — | |
| SCHEMBL23571130 | 0.65 | — | — | |
| SCHEMBL22679954 | 0.61 | — | — | |
| SCHEMBL23764812 | 0.60 | — | — | |
| SCHEMBL21770374 | 0.56 | — | — | |
| SCHEMBL22545570 | 0.54 | — | — |
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-2020072695-A1 | 8-AMINOISOQUINOLINE COMPOUNDS AND USES THEREOF | GENENTECH, INC. (US) | 2020-04-09 | — | — | WO | disclosed |