⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21496379 | 1.00 | — | — | |
| SCHEMBL10868305 | 1.00 | — | — | |
| SCHEMBL9161122 | 0.97 | — | — | |
| SCHEMBL3412633 | 0.92 | — | — | |
| SCHEMBL24701064 | 0.81 | — | — | |
| SCHEMBL19898868 | 0.78 | — | — | |
| SCHEMBL28986901 | 0.78 | — | — | |
| SCHEMBL9738577 | 0.78 | — | — | |
| SCHEMBL19148084 | 0.77 | OPRM1 (0.44) | — | |
| SCHEMBL5860265 | 0.75 | — | — |
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-0490221-B1 | Method for the production of unsaturated ethers | HOECHST AG (DE) | 1995-08-09 | — | — | EP | claimed |