⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13710885 | 0.96 | — | — | |
| SCHEMBL13856258 | 0.96 | — | — | |
| SCHEMBL13352644 | 0.96 | — | — | |
| SCHEMBL13856289 | 0.94 | — | — | |
| SCHEMBL13670705 | 0.94 | PTGES (0.30) | — | |
| SCHEMBL13849384 | 0.93 | — | — | |
| SCHEMBL13711378 | 0.92 | — | — | |
| SCHEMBL13333929 | 0.90 | FFAR4 (0.30) | — | |
| SCHEMBL13333491 | 0.90 | ESR1 (0.31) | — | |
| SCHEMBL13333635 | 0.89 | — | — |
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-2110376-A1 | Novel compounds for electronic material and organic electronic device using the same | Gracel Display Inc. (KR) | 2009-10-21 | — | — | EP | disclosed |