⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30776543 | 1.00 | — | — | |
| SCHEMBL26533528 | 1.00 | — | — | |
| SCHEMBL30587223 | 0.97 | — | — | |
| SCHEMBL30776271 | 0.97 | — | — | |
| SCHEMBL31278275 | 0.97 | — | — | |
| SCHEMBL26533585 | 0.97 | — | — | |
| SCHEMBL26116617 | 0.95 | — | — | |
| SCHEMBL30587229 | 0.94 | — | — | |
| SCHEMBL31556014 | 0.93 | — | — | |
| SCHEMBL26119116 | 0.92 | — | — |
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-119095853-A | KRAS inhibitors | 伊莱利利公司 | 2024-12-06 | — | — | CN | disclosed |