⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20291019 | 0.89 | — | — | |
| SCHEMBL20291371 | 0.84 | — | — | |
| SCHEMBL20291115 | 0.83 | — | — | |
| SCHEMBL20286888 | 0.83 | — | — | |
| SCHEMBL20286881 | 0.83 | — | — | |
| SCHEMBL20286904 | 0.82 | — | — | |
| SCHEMBL20286906 | 0.82 | — | — | |
| SCHEMBL20286908 | 0.81 | — | — | |
| SCHEMBL20286886 | 0.81 | — | — | |
| SCHEMBL20286892 | 0.81 | — | — |
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-20180175304-A1 | SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME | LG CHEM, LTD. (KR) | 2018-06-21 | — | — | US | disclosed |