⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19275956 | 0.92 | MEN1 (0.33) | — | |
| SCHEMBL23985958 | 0.91 | MEN1 (0.33) | — | |
| SCHEMBL22547545 | 0.89 | MEN1 (0.33) | — | |
| SCHEMBL22596735 | 0.88 | MEN1 (0.33) | — | |
| SCHEMBL26772405 | 0.85 | MEN1 (0.35) | — | |
| SCHEMBL24686409 | 0.83 | PLA2G2A (0.30) | — | |
| SCHEMBL24280968 | 0.83 | MAPK1 (0.34) | — | |
| SCHEMBL22547244 | 0.83 | MAPT (0.32) | — | |
| SCHEMBL23312903 | 0.82 | — | — | |
| SCHEMBL24594528 | 0.82 | MEN1 (0.38) | — |
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-3896073-A1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, AND ELECTRONIC APPARATUS INCLUDING ORGANIC LIGHT-EMITTING DEVICE | Samsung Electronics Co., Ltd. (KR) | 2021-10-20 | — | — | EP | disclosed |