⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17023956 | 0.92 | — | — | |
| SCHEMBL16208851 | 0.80 | — | — | |
| SCHEMBL29613367 | 0.57 | MEN1 (0.50) | — | |
| SCHEMBL22634162 | 0.57 | MEN1 (0.50) | — | |
| SCHEMBL12589215 | 0.54 | MEN1 (0.41) | — | |
| SCHEMBL31453886 | 0.53 | — | — | |
| SCHEMBL29656897 | 0.52 | CYP2A6 (0.52) | — | |
| SCHEMBL30366448 | 0.52 | CYP2A6 (0.52) | — | |
| SCHEMBL6562541 | 0.52 | CYP2A6 (0.52) | — | |
| SCHEMBL30366175 | 0.52 | CYP2A6 (0.52) | — |
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-9647216-B2 | Organic compound and organic light emitting diode device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-05-09 | — | — | US | disclosed |
| US-20150243898-A1 | ORGANIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME | PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) | 2015-08-27 | — | — | US | disclosed |