⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21515280 | 0.85 | L3MBTL1 (0.31) | — | |
| SCHEMBL26736723 | 0.84 | — | — | |
| SCHEMBL21515288 | 0.83 | ADORA2A (0.38) | — | |
| SCHEMBL22944786 | 0.83 | MAPT (0.35) | — | |
| SCHEMBL22944755 | 0.82 | PDE6D (0.31) | — | |
| SCHEMBL22945156 | 0.81 | PDE6D (0.31) | — | |
| SCHEMBL22944734 | 0.81 | PDE6D (0.31) | — | |
| SCHEMBL22945499 | 0.80 | BRDT (0.32) | — | |
| SCHEMBL21515401 | 0.80 | CYP1A2 (0.33) | — | |
| SCHEMBL21515456 | 0.80 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11812658-B2 | Compound and organic light emitting diode comprising same | LG CHEM, LTD. (KR) | 2023-11-07 | — | — | US | disclosed |
| US-20210036236-A1 | COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME | LG CHEM, LTD. (KR) | 2021-02-04 | — | — | US | disclosed |