⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17656847 | 0.92 | — | — | |
| SCHEMBL17656844 | 0.89 | — | — | |
| SCHEMBL17864667 | 0.86 | — | — | |
| SCHEMBL17864778 | 0.84 | — | — | |
| SCHEMBL18518104 | 0.82 | PDK2 (0.31) | — | |
| SCHEMBL17656880 | 0.81 | — | — | |
| SCHEMBL17656859 | 0.81 | — | — | |
| SCHEMBL19545016 | 0.80 | PDK2 (0.37) | — | |
| SCHEMBL17864736 | 0.80 | — | — | |
| SCHEMBL17864637 | 0.79 | — | — |
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-9238623-B2 | Condensed-cyclic compound and organic light-emitting diode including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-01-19 | — | — | US | disclosed |