⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20314994 | 0.81 | — | — | |
| SCHEMBL20936720 | 0.80 | — | — | |
| SCHEMBL26639368 | 0.79 | — | — | |
| SCHEMBL16158896 | 0.79 | — | — | |
| SCHEMBL16158891 | 0.79 | — | — | |
| SCHEMBL13073514 | 0.79 | — | — | |
| SCHEMBL18884704 | 0.77 | GAA (0.31) | — | |
| SCHEMBL18884705 | 0.77 | GAA (0.31) | — | |
| SCHEMBL18884703 | 0.77 | GAA (0.31) | — | |
| SCHEMBL27106324 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021152149-A1 | RAS INHIBITORS AND METHODS OF USING THE SAME | JAZZ PHARMACEUTICALS IRELAND LIMITED (IE) | 2021-08-05 | — | — | WO | disclosed |