⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20490029 | 0.77 | — | — | |
| SCHEMBL10429784 | 0.72 | TSHR (0.31) | — | |
| SCHEMBL9090316 | 0.72 | — | — | |
| SCHEMBL23585864 | 0.70 | — | — | |
| SCHEMBL7869515 | 0.69 | — | — | |
| SCHEMBL22340595 | 0.67 | — | — | |
| SCHEMBL21416728 | 0.67 | — | — | |
| SCHEMBL25920279 | 0.67 | — | — | |
| SCHEMBL24331614 | 0.67 | — | — | |
| SCHEMBL24498111 | 0.66 | — | — |
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-2023085046-A1 | ORGANIC COMPOUND, ORGANIC LIGHT EMITTING ELEMENT, DISPLAY DEVICE, PHOTOELECTRIC CONVERSION DEVICE, ELECTRONIC APPARATUS, ILLUMINATION DEVICE, MOVABLE BODY, AND EXPOSURE LIGHT SOURCE | キヤノン株式会社 | 2023-05-19 | — | — | WO | disclosed |