⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22067392 | 0.96 | BACE1 (0.30) | — | |
| SCHEMBL22067403 | 0.96 | BACE1 (0.30) | — | |
| SCHEMBL22067101 | 0.95 | BACE1 (0.31) | — | |
| SCHEMBL22066117 | 0.95 | BACE1 (0.31) | — | |
| SCHEMBL22067404 | 0.95 | — | — | |
| SCHEMBL22066713 | 0.95 | — | — | |
| SCHEMBL22067089 | 0.95 | — | — | |
| SCHEMBL22066709 | 0.95 | — | — | |
| SCHEMBL22066060 | 0.94 | — | — | |
| SCHEMBL22067473 | 0.94 | TNKS2 (0.30) | — |
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-20200185622-A1 | Novel Compound, and Organic Light Emitting Device and Organic Light Emitting Display Device Including the Same | DONGJIN SEMICHEM CO., LTD. (KR) | 2020-06-11 | — | — | US | disclosed |