⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21540807 | 0.72 | — | — | |
| SCHEMBL13370497 | 0.72 | — | — | |
| SCHEMBL20978527 | 0.71 | — | — | |
| SCHEMBL20842855 | 0.69 | — | — | |
| SCHEMBL22036017 | 0.68 | — | — | |
| SCHEMBL14625650 | 0.66 | — | — | |
| SCHEMBL8267538 | 0.65 | — | — | |
| SCHEMBL27337658 | 0.65 | — | — | |
| SCHEMBL18774021 | 0.65 | — | — | |
| SCHEMBL20910098 | 0.62 | — | — |
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-3487839-B1 | AMIDE DERIVATIVES AS NAV1.7 AND NAV1.8 BLOCKERS | RAQUALIA PHARMA INC (JP) | 2020-12-23 | — | — | EP | disclosed |