⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12136634 | 0.83 | NOTUM (0.32) | — | |
| SCHEMBL20088981 | 0.79 | — | — | |
| SCHEMBL2368336 | 0.77 | NOTUM (0.34) | — | |
| SCHEMBL4053334 | 0.74 | NOTUM (0.33) | — | |
| SCHEMBL3897073 | 0.74 | NOTUM (0.33) | — | |
| SCHEMBL4055343 | 0.74 | NOTUM (0.33) | — | |
| SCHEMBL130328 | 0.72 | — | — | |
| SCHEMBL17210860 | 0.72 | FDPS (0.34) | — | |
| SCHEMBL12136633 | 0.71 | — | — | |
| SCHEMBL29209440 | 0.70 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240228496-A1 | DEUTERIDE AND ORGANIC ELECTROLUMINESCENT ELEMENT | NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) | 2024-07-11 | — | — | US | disclosed |
| US-11659763-B2 | Metal complexes | MERCK PATENT GMBH | 2023-05-23 | — | — | US | disclosed |
| US-20210175441-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2021-06-10 | — | — | US | disclosed |
| EP-2595208-A1 | LIGHT EMITTING ELEMENT | Toray Industries, Inc. (JP) | 2013-05-22 | — | — | EP | disclosed |