⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31491045 | 0.82 | — | — | |
| SCHEMBL31490996 | 0.80 | — | — | |
| SCHEMBL31491032 | 0.78 | — | — | |
| SCHEMBL31355696 | 0.75 | — | — | |
| SCHEMBL30099309 | 0.75 | CYP11B1 (0.30) | — | |
| SCHEMBL31412213 | 0.75 | MAPT (0.34) | — | |
| SCHEMBL30699586 | 0.71 | — | — | |
| SCHEMBL22866847 | 0.68 | PTGES (0.30) | — | |
| SCHEMBL29560574 | 0.68 | PTGES (0.30) | — | |
| SCHEMBL24663897 | 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-119591588-A | RAS inhibitors | 泰励生物科技（上海）有限公司 | 2025-03-11 | — | — | CN | disclosed |