⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15991423 | 1.00 | — | — | |
| SCHEMBL15990919 | 1.00 | — | — | |
| SCHEMBL18707692 | 0.89 | CYP1A2 (0.31) | — | |
| SCHEMBL16166091 | 0.85 | — | — | |
| SCHEMBL16166138 | 0.84 | GAA (0.33) | — | |
| SCHEMBL15991076 | 0.82 | — | — | |
| SCHEMBL15990990 | 0.82 | — | — | |
| SCHEMBL20606729 | 0.76 | — | — | |
| SCHEMBL20606727 | 0.76 | — | — | |
| SCHEMBL20606730 | 0.76 | — | — |
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-2961749-B1 | PERFLUORINATED 5,6-DIHYDRO-4H-1,3-OXAZIN-2-AMINE COMPOUNDS AS BETA-SECRETASE INHIBITORS AND METHODS OF USE | AMGEN INC (US) | 2019-10-09 | — | — | EP | disclosed |