⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17989686 | 0.95 | KDM4E (0.31) | — | |
| SCHEMBL17989614 | 0.92 | — | — | |
| SCHEMBL17988885 | 0.89 | KDM4E (0.40) | — | |
| SCHEMBL17989617 | 0.87 | KDM4E (0.32) | — | |
| SCHEMBL17989623 | 0.87 | KDM4E (0.32) | — | |
| SCHEMBL17989694 | 0.87 | KDM4E (0.31) | — | |
| SCHEMBL17988917 | 0.86 | ALDH1A1 (0.32) | — | |
| SCHEMBL17989610 | 0.85 | — | — | |
| SCHEMBL17989622 | 0.85 | KDM4E (0.31) | — | |
| SCHEMBL18489088 | 0.84 | KDM4E (0.37) | — |
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-20160225992-A1 | ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-08-04 | — | — | US | disclosed |
| US-20160225992-A1 | ORGANIC LIGHT-EMITTING DEVICE | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-08-04 | — | — | US | disclosed |