⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25523665 | 1.00 | — | — | |
| SCHEMBL21673180 | 0.86 | KDM4E (0.33) | — | |
| SCHEMBL21845438 | 0.80 | ATM (0.35) | — | |
| SCHEMBL19570179 | 0.79 | KDM4E (0.37) | — | |
| SCHEMBL25944654 | 0.77 | IRAK4 (0.32) | — | |
| SCHEMBL21155888 | 0.76 | KDM4E (0.42) | — | |
| SCHEMBL20962487 | 0.76 | ATM (0.39) | — | |
| SCHEMBL19570071 | 0.76 | KDM4E (0.42) | — | |
| SCHEMBL20707565 | 0.75 | KDM4E (0.40) | — | |
| SCHEMBL22029987 | 0.74 | RORC (0.35) | — |
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-4188058-A1 | ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE HAVING THEREOF | LG Display Co., Ltd. (KR) | 2023-05-31 | — | — | EP | disclosed |