⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24824043 | 0.90 | THRB (0.32) | — | |
| SCHEMBL20857871 | 0.87 | THRB (0.34) | — | |
| SCHEMBL20857860 | 0.86 | MAPT (0.34) | — | |
| SCHEMBL21169810 | 0.86 | MEN1 (0.33) | — | |
| SCHEMBL24812301 | 0.84 | ALDH1A1 (0.33) | — | |
| SCHEMBL21169706 | 0.84 | SIGMAR1 (0.30) | — | |
| SCHEMBL21169808 | 0.84 | — | — | |
| SCHEMBL21169677 | 0.84 | — | — | |
| SCHEMBL27128200 | 0.84 | TP53 (0.30) | — | |
| SCHEMBL20857849 | 0.83 | TP53 (0.33) | — |
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-11552259-B1 | Organic electroluminescent element and electronic device | IDEMITSU KOSAN CO., LTD. (JP) | 2023-01-10 | — | — | US | disclosed |
| US-11527720-B1 | Organic electroluminescence device, electronic device, and compound | IDEMITSU KOSAN CO., LTD. (JP) | 2022-12-13 | — | — | US | disclosed |