⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8048996 | 0.82 | LOXL2 (0.46) | — | |
| SCHEMBL15591663 | 0.76 | — | — | |
| SCHEMBL21549405 | 0.76 | — | — | |
| SCHEMBL24311213 | 0.76 | — | — | |
| SCHEMBL17959496 | 0.73 | — | — | |
| SCHEMBL30831319 | 0.73 | — | — | |
| SCHEMBL15160640 | 0.73 | CHRNB2 (0.37) | — | |
| SCHEMBL723096 | 0.73 | — | — | |
| SCHEMBL14068603 | 0.72 | KCNH2 (0.37) | — | |
| SCHEMBL8067752 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019057946-A1 | MULTI-CYCLIC AROMATIC COMPOUNDS AS FACTOR D INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2019-03-28 | — | — | WO | disclosed |
| 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 |