⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1678779 | 0.80 | — | — | |
| SCHEMBL23693485 | 0.76 | PIK3CD (0.55) | — | |
| SCHEMBL20803869 | 0.75 | SLC6A2 (0.37) | — | |
| SCHEMBL23572078 | 0.74 | PIK3CD (0.40) | — | |
| SCHEMBL12448946 | 0.72 | — | — | |
| SCHEMBL1524887 | 0.71 | — | — | |
| SCHEMBL1338880 | 0.71 | CYP1A2 (0.44) | — | |
| SCHEMBL23943786 | 0.71 | GAA (0.31) | — | |
| SCHEMBL17592516 | 0.70 | MMP2 (0.34) | — | |
| SCHEMBL21633983 | 0.70 | GBA1 (0.33) | — |
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-2021208963-A1 | BCL-2 INHIBITOR | BEIGENE, LTD. (KY) | 2021-10-21 | — | — | WO | disclosed |