⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18314351 | 0.77 | SUCNR1 (0.34) | — | |
| SCHEMBL17265253 | 0.76 | — | — | |
| SCHEMBL17265254 | 0.74 | — | — | |
| SCHEMBL27405307 | 0.70 | SUCNR1 (0.42) | — | |
| SCHEMBL16077494 | 0.70 | SUCNR1 (0.42) | — | |
| SCHEMBL13626685 | 0.68 | — | — | |
| SCHEMBL13626689 | 0.68 | — | — | |
| SCHEMBL17265346 | 0.67 | — | — | |
| SCHEMBL19409276 | 0.66 | CA9 (0.35) | — | |
| SCHEMBL17636458 | 0.65 | SUCNR1 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022107013-A1 | SILVER ASSISTED GOLD CATALYSIS FOR THE PREPARATION OF FONDAPARINUX PENTASACCHARIDE AND INTERMEDIATES | INDIAN INSTITUTE OF SCIENCE EDUCATION AND RESEARCH (IN) | 2022-05-27 | — | — | WO | disclosed |