⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19084371 | 0.82 | — | — | |
| SCHEMBL25928331 | 0.81 | — | — | |
| SCHEMBL24352664 | 0.79 | ALOX5 (0.30) | — | |
| SCHEMBL27348280 | 0.78 | — | — | |
| SCHEMBL20462321 | 0.76 | — | — | |
| SCHEMBL26498922 | 0.76 | — | — | |
| SCHEMBL26483521 | 0.76 | — | — | |
| SCHEMBL18561903 | 0.74 | ALOX5 (0.40) | — | |
| SCHEMBL18589627 | 0.73 | ALOX5 (0.39) | — | |
| SCHEMBL22198498 | 0.72 | — | — |
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-20170069853-A1 | CONDENSED CYCLIC COMOPUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2017-03-09 | — | — | US | disclosed |