⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29512218 | 0.87 | LMNA (0.35) | — | |
| SCHEMBL17483438 | 0.87 | LMNA (0.35) | — | |
| SCHEMBL17883162 | 0.85 | CNR1 (0.36) | — | |
| SCHEMBL17851016 | 0.81 | — | — | |
| SCHEMBL17955070 | 0.79 | ESR2 (0.49) | — | |
| SCHEMBL17850974 | 0.77 | PDCD1 (0.30) | — | |
| SCHEMBL19344940 | 0.77 | PGR (0.36) | — | |
| SCHEMBL19345027 | 0.77 | STS (0.42) | — | |
| SCHEMBL17955092 | 0.76 | KDM4E (0.35) | — | |
| SCHEMBL17483443 | 0.75 | PDCD1 (0.35) | — |
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-3035401-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT | Kyushu University, National University Corporation (JP) | 2016-06-22 | — | — | EP | disclosed |