⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22995235 | 0.82 | — | — | |
| SCHEMBL22995352 | 0.75 | MAPT (0.41) | — | |
| SCHEMBL22995353 | 0.74 | — | — | |
| SCHEMBL3678234 | 0.66 | MEN1 (0.39) | — | |
| SCHEMBL4043723 | 0.60 | METAP2 (0.41) | — | |
| SCHEMBL4054698 | 0.59 | ADORA3 (0.40) | — | |
| SCHEMBL4048043 | 0.58 | METAP2 (0.37) | — | |
| SCHEMBL22995355 | 0.58 | — | — | |
| SCHEMBL4048086 | 0.57 | METAP2 (0.39) | — | |
| SCHEMBL3680239 | 0.57 | MEN1 (0.47) | — |
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-20210050527-A1 | ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME | P&H TECH (KR) | 2021-02-18 | — | — | US | disclosed |