⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2067798 | 0.86 | AAK1 (0.32) | — | |
| SCHEMBL2068061 | 0.79 | USP30 (0.39) | — | |
| SCHEMBL13029025 | 0.75 | USP30 (0.31) | — | |
| SCHEMBL27863750 | 0.71 | HDAC1 (0.38) | — | |
| SCHEMBL7871957 | 0.68 | DPP4 (0.36) | — | |
| SCHEMBL2068168 | 0.66 | USP30 (0.40) | — | |
| SCHEMBL2067004 | 0.66 | AAK1 (0.38) | — | |
| SCHEMBL3629295 | 0.65 | P2RX3 (0.32) | — | |
| SCHEMBL29920335 | 0.65 | P2RX3 (0.32) | — | |
| SCHEMBL28261500 | 0.63 | TSHR (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010139747-A1 | 1H-IMIDAZO[4, 5-c]QUINOLINONE COMPOUNDS, USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES | NOVARTIS AG (CH) | 2010-12-09 | — | — | WO | disclosed |