⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9051279 | 1.00 | — | — | |
| SCHEMBL9046790 | 1.00 | — | — | |
| SCHEMBL8909628 | 0.80 | LTB4R (0.34) | — | |
| SCHEMBL8910179 | 0.77 | LTB4R (0.33) | — | |
| SCHEMBL11582555 | 0.74 | MEN1 (0.36) | — | |
| SCHEMBL9050982 | 0.74 | THRB (0.32) | — | |
| SCHEMBL11243415 | 0.74 | — | — | |
| SCHEMBL9049665 | 0.74 | LTB4R (0.32) | — | |
| SCHEMBL8910701 | 0.71 | PDE4A (0.31) | — | |
| SCHEMBL8909986 | 0.70 | LTB4R (0.45) | — |
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-0611755-B1 | (Cyclohexyl)-alken compounds, process for their preparation and pharmaceutical compositions containing them | ADIR (FR) | 1996-07-10 | — | — | EP | disclosed |