⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25892173 | 0.82 | IRAK4 (0.34) | — | |
| SCHEMBL25316465 | 0.80 | HSD11B1 (0.37) | — | |
| SCHEMBL25316461 | 0.80 | HSD11B1 (0.37) | — | |
| SCHEMBL26029439 | 0.79 | — | — | |
| SCHEMBL25892125 | 0.77 | PTGS2 (0.37) | — | |
| SCHEMBL26026780 | 0.75 | SCN9A (0.32) | — | |
| SCHEMBL27346544 | 0.73 | GRIN2B (0.31) | — | |
| SCHEMBL30719523 | 0.72 | TRPV4 (0.39) | — | |
| SCHEMBL25890475 | 0.72 | HTR2A (0.33) | — | |
| SCHEMBL27346072 | 0.71 | PTGS2 (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 |
|---|---|---|---|---|---|---|---|
| WO-2023141323-A1 | EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF | BIOGEN MA INC. (US) | 2023-07-27 | — | — | WO | disclosed |