⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20515207 | 1.00 | — | — | |
| SCHEMBL217699 | 1.00 | — | — | |
| SCHEMBL1039848 | 0.92 | — | — | |
| SCHEMBL2534498 | 0.90 | CA12 (0.32) | — | |
| SCHEMBL386987 | 0.89 | — | — | |
| SCHEMBL1038465 | 0.84 | — | — | |
| SCHEMBL1036953 | 0.83 | HSD11B1 (0.31) | — | |
| SCHEMBL11437370 | 0.83 | DPP4 (0.31) | — | |
| SCHEMBL1040181 | 0.77 | — | — | |
| SCHEMBL11314043 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180280377-A1 | Imidazo[4,5-c]quinolin-2-one Compounds and Their Use in Treating Cancer | ASTRAZENECA UK LIMITED (GB) | 2018-10-04 | — | — | US | disclosed |