⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13799186 | 0.78 | MEN1 (0.30) | — | |
| SCHEMBL9946146 | 0.70 | ALDH1A1 (0.32) | — | |
| SCHEMBL9946145 | 0.70 | — | — | |
| SCHEMBL15882675 | 0.69 | SLC9A1 (0.33) | — | |
| SCHEMBL17863581 | 0.68 | MAPK1 (0.37) | — | |
| SCHEMBL30518 | 0.66 | PGR (0.40) | — | |
| SCHEMBL12745953 | 0.66 | — | — | |
| SCHEMBL22820750 | 0.65 | — | — | |
| SCHEMBL20050347 | 0.65 | — | — | |
| SCHEMBL19626190 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210317108-A1 | ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES | SAMSUNG DISPLAY CO., LTD. (KR) | 2021-10-14 | — | — | US | disclosed |