⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25450501 | 0.78 | — | — | |
| SCHEMBL24508042 | 0.75 | APLNR (0.33) | — | |
| SCHEMBL18945319 | 0.71 | — | — | |
| SCHEMBL18160268 | 0.71 | — | — | |
| SCHEMBL15629712 | 0.71 | HSD11B1 (0.30) | — | |
| SCHEMBL17451650 | 0.71 | HSD11B1 (0.30) | — | |
| SCHEMBL5669103 | 0.71 | — | — | |
| SCHEMBL11955215 | 0.69 | RECQL (0.34) | — | |
| SCHEMBL13877832 | 0.69 | ALDH1A1 (0.31) | — | |
| SCHEMBL13877831 | 0.69 | — | — |
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-20230058189-A1 | QUINOLIN-4-ONE AND 4(1H)-CINNOLINONE COMPOUNDS AND METHODS OF USING SAME | Frequency Therapeutics, Inc. (US) | 2023-02-23 | — | — | US | disclosed |