⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17864706 | 0.92 | — | — | |
| SCHEMBL17864650 | 0.88 | — | — | |
| SCHEMBL17864637 | 0.86 | — | — | |
| SCHEMBL17864629 | 0.84 | — | — | |
| SCHEMBL17656847 | 0.81 | — | — | |
| SCHEMBL17864638 | 0.81 | — | — | |
| SCHEMBL17862409 | 0.79 | AHR (0.33) | — | |
| SCHEMBL17656844 | 0.78 | — | — | |
| SCHEMBL17862333 | 0.78 | AHR (0.33) | — | |
| SCHEMBL18974809 | 0.78 | — | — |
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-20160181543-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE | IDEMITSU KOSAN CO., LTD. (JP) | 2016-06-23 | — | — | US | disclosed |