⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21676671 | 0.94 | LMNA (0.41) | — | |
| SCHEMBL10347592 | 0.92 | LMNA (0.44) | — | |
| SCHEMBL1117295 | 0.92 | LMNA (0.44) | — | |
| SCHEMBL6138301 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL25219155 | 0.86 | — | — | |
| SCHEMBL24485628 | 0.77 | HTR2A (0.33) | — | |
| Hydrochloric Acid SCHEMBL32690073 | 0.75 | HTR2A (0.34) | — | |
| SCHEMBL22967856 | 0.74 | — | — | |
| SCHEMBL10077890 | 0.74 | — | — | |
| SCHEMBL5022562 | 0.72 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021063346-A1 | KRAS G12C INHIBITOR AND APPLICATION THEREOF | 上海迪诺医药科技有限公司 | 2021-04-08 | — | — | WO | disclosed |
| US-20210040089-A1 | KRAS MUTANT PROTEIN INHIBITORS | JACOBIO PHARMACEUTICALS CO., LTD. | 2021-02-11 | — | — | US | disclosed |
| WO-2021023247-A1 | KRAS MUTANT PROTEIN INHIBITOR | JACOBIO PHARMACEUTICALS CO., LTD. (CN) | 2021-02-11 | — | — | WO | disclosed |