⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24735504 | 0.89 | MEN1 (0.34) | — | |
| SCHEMBL20960220 | 0.88 | MEN1 (0.33) | — | |
| SCHEMBL18562421 | 0.87 | KDM4E (0.33) | — | |
| SCHEMBL24735464 | 0.86 | KDM4E (0.30) | — | |
| SCHEMBL12065487 | 0.84 | MAPT (0.37) | — | |
| SCHEMBL18560844 | 0.84 | ABCG2 (0.32) | — | |
| SCHEMBL27409783 | 0.83 | KDM4E (0.33) | — | |
| SCHEMBL22540157 | 0.81 | KDM4E (0.31) | — | |
| SCHEMBL20041285 | 0.80 | KMT2A (0.38) | — | |
| SCHEMBL26057812 | 0.80 | KDM4E (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 |
|---|---|---|---|---|---|---|---|
| WO-2022255403-A1 | COMPOUND AND ORGANIC ELECTROLUMINESCENCE ELEMENT | 三菱ケミカル株式会社 | 2022-12-08 | — | — | WO | disclosed |