⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12168498 | 0.94 | MEN1 (0.33) | — | |
| SCHEMBL2713322 | 0.94 | MEN1 (0.33) | — | |
| SCHEMBL15200760 | 0.94 | MEN1 (0.33) | — | |
| SCHEMBL12098779 | 0.89 | — | — | |
| SCHEMBL18665472 | 0.86 | MEN1 (0.32) | — | |
| SCHEMBL22400743 | 0.86 | — | — | |
| SCHEMBL17300593 | 0.84 | TYR (0.31) | — | |
| SCHEMBL27934334 | 0.83 | — | — | |
| SCHEMBL14868190 | 0.83 | — | — | |
| SCHEMBL2710930 | 0.82 | MEN1 (0.30) | — |
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-2501698-B1 | FLUORINATED MONOMERS, OLIGOMERS AND POLYMERS FOR USE IN ORGANIC ELECTRONIC DEVICES | NAT RES COUNCIL CANADA (CA) | 2018-04-25 | — | — | EP | disclosed |