⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22063728 | 1.00 | — | — | |
| SCHEMBL25943592 | 0.91 | — | — | |
| SCHEMBL24849520 | 0.90 | — | — | |
| SCHEMBL20192020 | 0.90 | — | — | |
| SCHEMBL23129895 | 0.88 | — | — | |
| SCHEMBL22180690 | 0.87 | — | — | |
| SCHEMBL24609459 | 0.86 | KDM4E (0.30) | — | |
| SCHEMBL22895187 | 0.84 | — | — | |
| SCHEMBL27307024 | 0.84 | CXCR5 (0.30) | — | |
| SCHEMBL18557056 | 0.82 | KDM4E (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024085588-A1 | COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE | 삼성에스디아이 주식회사 | 2024-04-25 | — | — | WO | disclosed |