⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16622856 | 0.77 | MAOB (0.38) | — | |
| SCHEMBL19720843 | 0.76 | MAOB (0.37) | — | |
| SCHEMBL13446801 | 0.69 | ALDH1A1 (0.36) | — | |
| SCHEMBL22755932 | 0.69 | ALDH1A1 (0.36) | — | |
| SCHEMBL13417873 | 0.69 | ALDH1A1 (0.36) | — | |
| SCHEMBL13357056 | 0.69 | ALDH1A1 (0.36) | — | |
| SCHEMBL19443827 | 0.69 | MEN1 (0.32) | — | |
| SCHEMBL24054612 | 0.68 | ALDH1A1 (0.39) | — | |
| SCHEMBL22085633 | 0.68 | ALDH1A1 (0.39) | — | |
| SCHEMBL20018799 | 0.68 | ALDH1A1 (0.39) | — |
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-3214153-B1 | ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG DISPLAY CO LTD (KR) | 2020-03-25 | — | — | EP | disclosed |