⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8498907 | 0.79 | DRD4 (0.34) | — | |
| SCHEMBL25743432 | 0.75 | CACNA1H (0.34) | — | |
| SCHEMBL25743378 | 0.75 | CACNA1H (0.34) | — | |
| SCHEMBL24952005 | 0.73 | DRD4 (0.33) | — | |
| SCHEMBL25707699 | 0.71 | CACNA1H (0.31) | — | |
| SCHEMBL24765660 | 0.70 | CACNA1H (0.31) | — | |
| SCHEMBL25123398 | 0.69 | EPHA2 (0.33) | — | |
| SCHEMBL23323134 | 0.69 | DRD4 (0.31) | — | |
| SCHEMBL25122589 | 0.69 | EPHA2 (0.33) | — | |
| SCHEMBL26018658 | 0.67 | EPHA2 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230159522-A1 | BCL-2 INHIBITOR | BEONE MEDICINES I GMBH (CH) | 2023-05-25 | — | — | US | disclosed |