⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22848948 | 0.87 | HRH3 (0.37) | — | |
| SCHEMBL22837733 | 0.87 | PIK3CD (0.38) | — | |
| SCHEMBL26465870 | 0.87 | HRH3 (0.37) | — | |
| SCHEMBL24379841 | 0.87 | PIK3CD (0.38) | — | |
| SCHEMBL21106666 | 0.87 | PIK3CD (0.38) | — | |
| SCHEMBL22856067 | 0.87 | HRH3 (0.37) | — | |
| SCHEMBL22856339 | 0.84 | GBA1 (0.33) | — | |
| SCHEMBL22837765 | 0.84 | GBA1 (0.33) | — | |
| SCHEMBL22837759 | 0.84 | GBA1 (0.33) | — | |
| SCHEMBL23559954 | 0.82 | EPHA2 (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-2022125790-A1 | IRAK DEGRADERS AND USES THEREOF | KYMERA THERAPEUTICS, INC. (US) | 2022-06-16 | — | — | WO | disclosed |