⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22311666 | 0.98 | — | — | |
| SCHEMBL22311752 | 0.95 | TNKS (0.31) | — | |
| SCHEMBL22310090 | 0.93 | — | — | |
| SCHEMBL22311669 | 0.93 | TNKS (0.30) | — | |
| SCHEMBL22311667 | 0.92 | — | — | |
| SCHEMBL22311764 | 0.91 | — | — | |
| SCHEMBL22310870 | 0.91 | KDM4E (0.32) | — | |
| SCHEMBL22310867 | 0.91 | KDM4E (0.31) | — | |
| SCHEMBL22310884 | 0.91 | — | — | |
| SCHEMBL22311670 | 0.91 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020159334-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | 주식회사 엘지화학 | 2020-08-06 | — | — | WO | disclosed |