⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25354645 | 1.00 | — | — | |
| SCHEMBL7716269 | 0.64 | — | — | |
| SCHEMBL3153530 | 0.63 | — | — | |
| SCHEMBL23567260 | 0.59 | — | — | |
| SCHEMBL13456780 | 0.59 | USP2 (0.31) | — | |
| SCHEMBL23567317 | 0.58 | CYP1A2 (0.31) | — | |
| SCHEMBL23567298 | 0.57 | MAPT (0.34) | — | |
| SCHEMBL23567233 | 0.57 | MAPT (0.34) | — | |
| SCHEMBL23567242 | 0.57 | MAPT (0.34) | — | |
| SCHEMBL23567227 | 0.57 | MAPT (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3969459-B1 | PROCESS AND INTERMEDIATES FOR THE PREPARATION OF ELDECALCITOL | FAES FARMA SA (ES) | 2023-08-23 | — | — | EP | disclosed |