⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13819844 | 0.82 | MEN1 (0.34) | — | |
| SCHEMBL26318220 | 0.81 | MEN1 (0.33) | — | |
| SCHEMBL13854737 | 0.79 | HSD17B1 (0.32) | — | |
| SCHEMBL13900309 | 0.79 | KMT2A (0.37) | — | |
| SCHEMBL25827048 | 0.79 | ALDH1A1 (0.34) | — | |
| SCHEMBL20466593 | 0.71 | MAPT (0.33) | — | |
| SCHEMBL20342997 | 0.70 | TRPM8 (0.33) | — | |
| SCHEMBL21420061 | 0.69 | MAPT (0.39) | — | |
| SCHEMBL13471747 | 0.68 | TP53 (0.31) | — | |
| SCHEMBL26734798 | 0.68 | — | — |
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-3578564-A1 | NOVEL HETEROLEPTIC IRIDIUM COMPLEXES | Universal Display Corporation (US) | 2019-12-11 | — | — | EP | disclosed |