⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18619266 | 0.97 | — | — | |
| SCHEMBL18619051 | 0.97 | — | — | |
| SCHEMBL18619003 | 0.94 | — | — | |
| SCHEMBL18620742 | 0.94 | — | — | |
| SCHEMBL18620746 | 0.91 | KDM4E (0.32) | — | |
| SCHEMBL18619038 | 0.91 | — | — | |
| SCHEMBL18620725 | 0.91 | — | — | |
| SCHEMBL18619017 | 0.90 | — | — | |
| SCHEMBL18619270 | 0.90 | KDM4E (0.31) | — | |
| SCHEMBL18620197 | 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 |
|---|---|---|---|---|---|---|---|
| WO-2017038728-A1 | COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | 出光興産株式会社 | 2017-03-09 | — | — | WO | disclosed |