⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20198957 | 0.93 | — | — | |
| SCHEMBL20198902 | 0.88 | ANO1 (0.30) | — | |
| SCHEMBL20198981 | 0.88 | ANO1 (0.30) | — | |
| SCHEMBL20198901 | 0.87 | ANO1 (0.32) | — | |
| SCHEMBL20198934 | 0.86 | — | — | |
| SCHEMBL20198912 | 0.86 | NPC1 (0.31) | — | |
| SCHEMBL20174754 | 0.86 | ANO1 (0.31) | — | |
| SCHEMBL20198962 | 0.86 | ANO1 (0.31) | — | |
| SCHEMBL20174779 | 0.85 | PDK2 (0.30) | — | |
| SCHEMBL20198891 | 0.85 | PDK2 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10781366-B2 | Spiro compound and organic light-emitting device comprising same | LG CHEM, LTD. (KR) | 2020-09-22 | — | — | US | disclosed |
| US-20180148639-A1 | SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | LG CHEM, LTD. (KR) | 2018-05-31 | — | — | US | disclosed |
| US-20180148639-A1 | SPIRO COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | LG CHEM, LTD. (KR) | 2018-05-31 | — | — | US | disclosed |