⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22181581 | 0.89 | LPL (0.34) | — | |
| SCHEMBL22181580 | 0.79 | LPL (0.31) | — | |
| SCHEMBL22159670 | 0.78 | LPL (0.34) | — | |
| SCHEMBL31676639 | 0.78 | LPL (0.34) | — | |
| SCHEMBL26875067 | 0.73 | AHR (0.38) | — | |
| SCHEMBL25141258 | 0.72 | AHR (0.32) | — | |
| SCHEMBL18563346 | 0.72 | AHR (0.43) | — | |
| SCHEMBL22159669 | 0.71 | LIPG (0.42) | — | |
| SCHEMBL22159671 | 0.71 | LIPG (0.42) | — | |
| SCHEMBL16889221 | 0.71 | MAOA (0.36) | — |
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-11248009-B2 | Polycyclic aromatic compound, material for an organic device, organic electroluminescent element, display apparatus and lighting apparatus | KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) | 2022-02-15 | — | — | US | disclosed |
| US-20200207787-A1 | POLYCYCLIC AROMATIC COMPOUND, MATERIAL FOR AN ORGANIC DEVICE, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY APPARATUS AND LIGHTING APPARATUS | KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) | 2020-07-02 | — | — | US | disclosed |