⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25775873 | 0.97 | PDK2 (0.30) | — | |
| SCHEMBL25783524 | 0.97 | PDK2 (0.30) | — | |
| SCHEMBL25775708 | 0.94 | PDK2 (0.32) | — | |
| SCHEMBL25784614 | 0.93 | — | — | |
| SCHEMBL25784728 | 0.93 | — | — | |
| SCHEMBL25783285 | 0.93 | — | — | |
| SCHEMBL25783122 | 0.93 | — | — | |
| SCHEMBL14600397 | 0.93 | PDK2 (0.32) | — | |
| SCHEMBL25783842 | 0.93 | — | — | |
| SCHEMBL12770689 | 0.92 | DHFR (0.31) | — |
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-20230212334-A1 | POLYMER, ELECTROLUMINESCENCE MATERIAL, ELECTROLUMINESCENCE DEVICE, AND ELECTRONIC DEVICE | SAMSUNG ELECTRONICS CO LTD (KR) | 2023-07-06 | — | — | US | disclosed |