⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25051748 | 0.93 | — | — | |
| SCHEMBL22315541 | 0.93 | HCRTR1 (0.31) | — | |
| SCHEMBL22310835 | 0.91 | PRKDC (0.32) | — | |
| SCHEMBL25051244 | 0.90 | SIRT2 (0.31) | — | |
| SCHEMBL25051416 | 0.90 | — | — | |
| SCHEMBL25051245 | 0.90 | TSHR (0.31) | — | |
| SCHEMBL25051173 | 0.89 | TDP1 (0.31) | — | |
| SCHEMBL22311286 | 0.89 | TSHR (0.31) | — | |
| SCHEMBL23736547 | 0.89 | PRKDC (0.32) | — | |
| SCHEMBL22315462 | 0.87 | SIRT2 (0.32) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230049674-A1 | ORGANIC LIGHT EMITTING DEVICE | LG CHEM, LTD. (KR) | 2023-02-16 | — | — | US | disclosed |
| WO-2020159333-A1 | COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2020-08-06 | — | — | WO | disclosed |