⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26065394 | 0.92 | — | — | |
| SCHEMBL26065735 | 0.91 | HTR2A (0.33) | — | |
| SCHEMBL26065251 | 0.78 | CYP11B2 (0.37) | — | |
| SCHEMBL26065560 | 0.76 | PTPN11 (0.33) | — | |
| SCHEMBL26065259 | 0.76 | — | — | |
| SCHEMBL26065417 | 0.75 | PDE10A (0.33) | — | |
| SCHEMBL26065939 | 0.75 | PDCD1LG2 (0.32) | — | |
| SCHEMBL25370940 | 0.73 | TRPV4 (0.40) | — | |
| SCHEMBL26066080 | 0.72 | HTR2A (0.32) | — | |
| SCHEMBL26065482 | 0.72 | AR (0.32) | — |
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-2023164063-A1 | EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF | BIOGEN MA INC. (US) | 2023-08-31 | — | — | WO | disclosed |