⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12799339 | 0.96 | — | — | |
| SCHEMBL17857204 | 0.83 | PDK2 (0.31) | — | |
| SCHEMBL17857199 | 0.68 | — | — | |
| SCHEMBL14278991 | 0.68 | ACHE (0.39) | — | |
| SCHEMBL13933163 | 0.68 | ACHE (0.39) | — | |
| SCHEMBL16167860 | 0.67 | PDK2 (0.37) | — | |
| SCHEMBL12862430 | 0.67 | MAOA (0.34) | — | |
| SCHEMBL12880610 | 0.66 | — | — | |
| SCHEMBL16167863 | 0.64 | PDK2 (0.34) | — | |
| SCHEMBL21708940 | 0.63 | KDM4E (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180130853-A1 | DISPLAY COMPONENT AND MANUFACTURING METHOD THEREFOR | GUANGZHOU CHINARAY OPTOELECTRONICS MATERIALS LTD. (CN) | 2018-05-10 | — | — | US | disclosed |