⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4772450 | 0.76 | CNR2 (0.37) | — | |
| SCHEMBL17610639 | 0.73 | CACNA1H (0.36) | — | |
| SCHEMBL3610412 | 0.72 | — | — | |
| SCHEMBL17316550 | 0.71 | — | — | |
| SCHEMBL2067822 | 0.68 | MAPT (0.36) | — | |
| SCHEMBL743397 | 0.68 | MAPT (0.40) | — | |
| SCHEMBL4778875 | 0.68 | HRH3 (0.37) | — | |
| SCHEMBL182759 | 0.68 | ALDH1A1 (0.44) | — | |
| SCHEMBL5468976 | 0.68 | PIM1 (0.36) | — | |
| SCHEMBL1316269 | 0.67 | MAPT (0.41) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070265256-A1 | Phosphodiesterase 10 inhibitors | AMGEN INC. | 2007-11-15 | — | — | US | claimed |
| EP-1991530-A1 | CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS | Amgen Inc. (US) | 2008-11-19 | — | — | EP | disclosed |
| US-20070265256-A1 | Phosphodiesterase 10 inhibitors | AMGEN INC. | 2007-11-15 | — | — | US | disclosed |
| WO-2007098169-A1 | CINNOLINE DERIVATIVES AS PHOSPHODIESTERASE 10 INHIBITORS | AMGEN INC. (US) | 2007-08-30 | — | — | WO | disclosed |