⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19009878 | 0.90 | — | — | |
| SCHEMBL19009837 | 0.88 | TOP2A (0.34) | — | |
| SCHEMBL19009817 | 0.80 | TOP1 (0.34) | — | |
| SCHEMBL19009824 | 0.79 | TOP1 (0.33) | — | |
| SCHEMBL19009825 | 0.72 | TOP1 (0.36) | — | |
| SCHEMBL19009811 | 0.70 | TOP2A (0.36) | — | |
| SCHEMBL19009799 | 0.69 | TOP1 (0.35) | — | |
| SCHEMBL19009816 | 0.68 | TOP2A (0.33) | — | |
| SCHEMBL19051769 | 0.68 | TOP2A (0.34) | — | |
| SCHEMBL19009800 | 0.68 | TOP1 (0.38) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170179407-A1 | CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-06-22 | — | — | US | disclosed |
| US-20170179407-A1 | CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-06-22 | — | — | US | disclosed |