⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL214086 | 1.00 | — | — | |
| SCHEMBL2767067 | 0.92 | — | — | |
| SCHEMBL6373282 | 0.90 | LMNA (0.38) | — | |
| SCHEMBL3913590 | 0.82 | — | — | |
| SCHEMBL15920358 | 0.82 | — | — | |
| SCHEMBL28708 | 0.82 | — | — | |
| SCHEMBL27517780 | 0.82 | LMNA (0.33) | — | |
| SCHEMBL27510526 | 0.82 | LMNA (0.33) | — | |
| Butyl Alcohol SCHEMBL7087737 | 0.80 | ALDH1A1 (0.50) | — | |
| SCHEMBL27203930 | 0.80 | ALOX5 (0.33) | — |
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-2018862-A1 | Substituted piperidines as therapeutic compounds | Speedel Experimenta AG (CH) | 2009-01-28 | — | — | EP | disclosed |