⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3411941 | 0.73 | — | — | |
| SCHEMBL360296 | 0.73 | — | — | |
| SCHEMBL23367917 | 0.71 | — | — | |
| SCHEMBL17461171 | 0.71 | — | — | |
| Water SCHEMBL1682249 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL1801987 | 0.71 | — | — | |
| Bromide SCHEMBL3245761 | 0.71 | — | — | |
| SCHEMBL21728033 | 0.69 | — | — | |
| SCHEMBL15906727 | 0.69 | — | — | |
| SCHEMBL25575016 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2773638-B1 | HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS AS INHIBITORS OF BTK ACTIVITY | HOFFMANN LA ROCHE (CH) | 2015-10-07 | — | — | EP | disclosed |