⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15113569 | 0.79 | FFAR3 (0.39) | — | |
| SCHEMBL16407839 | 0.74 | FFAR3 (0.39) | — | |
| SCHEMBL10017923 | 0.74 | FFAR3 (0.48) | — | |
| SCHEMBL5522190 | 0.72 | FFAR3 (0.52) | — | |
| SCHEMBL20617829 | 0.72 | FFAR3 (0.33) | — | |
| SCHEMBL19814611 | 0.70 | PKM (0.42) | — | |
| SCHEMBL26201787 | 0.70 | FFAR3 (0.32) | — | |
| SCHEMBL15113570 | 0.70 | FFAR3 (0.38) | — | |
| SCHEMBL13356443 | 0.70 | FFAR3 (0.38) | — | |
| SCHEMBL23370968 | 0.68 | FFAR3 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230030115-A1 | RHO-ASSOCIATED PROTEIN KINASE INHIBITOR, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND PREPARATION METHOD AND USE THEREOF | BEIJING TIDE PHARMACEUTICAL CO LTD (CN) | 2023-02-02 | — | — | US | disclosed |
| US-20220378743-A1 | METHOD FOR TREATING FATTY LIVER DISEASE AND/OR STEATOHEPATITIS | BEIJING TIDE PHARMACEUTICAL CO., LTD. (CN) | 2022-12-01 | — | — | US | disclosed |