⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18732206 | 0.72 | — | — | |
| SCHEMBL16769959 | 0.72 | — | — | |
| SCHEMBL21431208 | 0.69 | — | — | |
| SCHEMBL25247596 | 0.67 | — | — | |
| SCHEMBL25338571 | 0.66 | APLNR (0.35) | — | |
| SCHEMBL16583519 | 0.66 | LPL (0.46) | — | |
| SCHEMBL4759484 | 0.66 | — | — | |
| SCHEMBL19071717 | 0.64 | — | — | |
| Cyclopentane SCHEMBL25390598 | 0.63 | — | — | |
| SCHEMBL25436391 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3212630-B1 | NEW DIHYDROQUINOLINE PYRAZOLYL COMPOUNDS | HOFFMANN LA ROCHE (CH) | 2022-05-18 | — | — | EP | disclosed |
| WO-2020212408-A1 | COMPOUND, ORGANIC SEMICONDUCTING MATERIAL COMPRISING THE SAME, ORGANIC ELECTRONIC DEVICE COMPRISING THE SAME, AND DISPLAY DEVICE AND LIGHTING DEVICE COMPRISING THE SAME | NOVALED GMBH (DE) | 2020-10-22 | — | — | WO | disclosed |
| US-20080269209-A1 | Pyrazoloisoquinoline Derivatives | PALAU PHARMA, S.A. (ES) | 2008-10-30 | — | — | US | disclosed |