⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29922123 | 0.67 | — | — | |
| SCHEMBL30665762 | 0.67 | — | — | |
| SCHEMBL30035230 | 0.65 | — | — | |
| SCHEMBL806334 | 0.54 | — | — | |
| SCHEMBL806335 | 0.52 | — | — | |
| SCHEMBL21676505 | 0.52 | — | — | |
| SCHEMBL21500439 | 0.46 | — | — | |
| SCHEMBL11732960 | 0.45 | — | — | |
| SCHEMBL18691332 | 0.42 | — | — | |
| SCHEMBL10993767 | 0.40 | — | — |
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-20070299067-A1 | Quinoline and isoquinoline derivatives as phosphodiesterase 10 inhibitors | AMGEN INC. | 2007-12-27 | — | — | US | claimed |
| US-20070299067-A1 | Quinoline and isoquinoline derivatives as phosphodiesterase 10 inhibitors | AMGEN INC. | 2007-12-27 | — | — | US | disclosed |