⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24772368 | 0.84 | NOS3 (0.31) | — | |
| SCHEMBL26914650 | 0.84 | — | — | |
| SCHEMBL8380419 | 0.82 | — | — | |
| SCHEMBL20466912 | 0.82 | — | — | |
| SCHEMBL8380416 | 0.82 | — | — | |
| SCHEMBL11593533 | 0.80 | — | — | |
| SCHEMBL910156 | 0.79 | — | — | |
| SCHEMBL15701469 | 0.77 | — | — | |
| SCHEMBL22915352 | 0.76 | — | — | |
| SCHEMBL19144819 | 0.75 | — | — |
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-4099413-A1 | COMPOSITION, LAYER INCLUDING THE COMPOSITION, LIGHT-EMITTING DEVICE INCLUDING THE COMPOSITION, AND ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE | Samsung Electronics Co., Ltd. (KR) | 2022-12-07 | — | — | EP | disclosed |