⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11814651 | 0.83 | — | — | |
| SCHEMBL16168166 | 0.76 | — | — | |
| SCHEMBL19353780 | 0.72 | ALDH1A1 (0.35) | — | |
| SCHEMBL20810118 | 0.72 | — | — | |
| SCHEMBL14406988 | 0.72 | — | — | |
| SCHEMBL15298996 | 0.70 | PTGS1 (0.34) | — | |
| SCHEMBL137715 | 0.70 | PTGS1 (0.34) | — | |
| SCHEMBL24005067 | 0.69 | — | — | |
| SCHEMBL28861159 | 0.69 | PTGS1 (0.33) | — | |
| SCHEMBL14020469 | 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 |
|---|---|---|---|---|---|---|---|
| WO-2021222174-A1 | BCL-2 INHIBITORS AND THEIR USE AS PHARMACEUTICALS | PRELUDE THERAPEUTICS INCORPORATED (US) | 2021-11-04 | — | — | WO | disclosed |