⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20174941 | 0.95 | KDM4E (0.30) | — | |
| SCHEMBL20174940 | 0.95 | KDM4E (0.30) | — | |
| SCHEMBL20174959 | 0.92 | — | — | |
| SCHEMBL20199225 | 0.89 | PTPN1 (0.33) | — | |
| SCHEMBL20174928 | 0.89 | PTPN1 (0.33) | — | |
| SCHEMBL20174926 | 0.89 | PTPN1 (0.33) | — | |
| SCHEMBL20199242 | 0.89 | PTPN1 (0.33) | — | |
| SCHEMBL20199273 | 0.89 | PTPN1 (0.33) | — | |
| SCHEMBL20174905 | 0.89 | PTPN1 (0.33) | — | |
| SCHEMBL20174932 | 0.89 | PTPN1 (0.33) | — |
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 |