⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21341470 | 0.74 | HDAC10 (0.39) | — | |
| SCHEMBL21341405 | 0.72 | — | — | |
| SCHEMBL24944145 | 0.70 | EIF4A3 (0.33) | — | |
| SCHEMBL31265044 | 0.63 | PGR (0.43) | — | |
| SCHEMBL21341402 | 0.61 | CFTR (0.37) | — | |
| SCHEMBL21341404 | 0.60 | KDM4E (0.30) | — | |
| SCHEMBL21341334 | 0.57 | CCR9 (0.39) | — | |
| SCHEMBL31265066 | 0.55 | HSD17B10 (0.40) | — | |
| SCHEMBL24943811 | 0.55 | CCR9 (0.38) | — | |
| SCHEMBL21983448 | 0.55 | CCR9 (0.37) | — |
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-20220378743-A1 | METHOD FOR TREATING FATTY LIVER DISEASE AND/OR STEATOHEPATITIS | BEIJING TIDE PHARMACEUTICAL CO., LTD. (CN) | 2022-12-01 | — | — | US | disclosed |