⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL516398 | 1.00 | — | — | |
| SCHEMBL1485870 | 0.84 | FAAH (0.39) | — | |
| SCHEMBL19194651 | 0.84 | FAAH (0.39) | — | |
| SCHEMBL1485701 | 0.84 | FAAH (0.39) | — | |
| SCHEMBL27610342 | 0.82 | — | — | |
| SCHEMBL14731056 | 0.80 | FAAH (0.50) | — | |
| SCHEMBL13716847 | 0.80 | FAAH (0.50) | — | |
| SCHEMBL417792 | 0.80 | FAAH (0.50) | — | |
| SCHEMBL1485893 | 0.80 | — | — | |
| SCHEMBL13194684 | 0.80 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2771331-A1 | NOVEL PROCESS | Givaudan SA (CH) | 2014-09-03 | — | — | EP | claimed |
| WO-2013060818-A1 | NOVEL PROCESS | GIVAUDAN SA (CH) | 2013-05-02 | — | — | WO | claimed |
| WO-2013060011-A1 | NOVEL PROCESS | GIVAUDAN SA (CH) | 2013-05-02 | — | — | WO | claimed |