⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22262859 | 0.76 | — | — | |
| SCHEMBL12002488 | 0.74 | — | — | |
| SCHEMBL641084 | 0.73 | — | — | |
| SCHEMBL2896160 | 0.72 | — | — | |
| SCHEMBL769048 | 0.71 | DGAT1 (0.37) | — | |
| SCHEMBL2203061 | 0.69 | MAPT (0.31) | — | |
| SCHEMBL31250333 | 0.69 | — | — | |
| SCHEMBL161037 | 0.69 | CYP2C9 (0.35) | — | |
| SCHEMBL2580539 | 0.68 | — | — | |
| SCHEMBL31637479 | 0.68 | LMNA (0.31) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111527084-B | Isofuranone compounds useful as HPK1 inhibitors | 百时美施贵宝公司 | 2023-07-18 | — | — | CN | disclosed |
| EP-3707138-B1 | ISOFURANONE COMPOUNDS USEFUL AS HPK1 INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2022-07-13 | — | — | EP | disclosed |
| US-11166959-B2 | Isofuranone compounds useful as HPK1 inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2021-11-09 | — | — | US | disclosed |
| US-20200390776-A1 | ISOFURANONE COMPOUNDS USEFUL AS HPK1 INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2020-12-17 | — | — | US | disclosed |
| CN-111527084-A | Isofuranone compounds useful as HPK1 inhibitors | 百时美施贵宝公司 | 2020-08-11 | — | — | CN | disclosed |