⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2703530 | 0.75 | — | — | |
| SCHEMBL423678 | 0.73 | — | — | |
| SCHEMBL1746596 | 0.71 | — | — | |
| SCHEMBL7612633 | 0.71 | — | — | |
| Benzene SCHEMBL28852901 | 0.69 | KEAP1 (0.37) | — | |
| SCHEMBL7881734 | 0.69 | — | — | |
| SCHEMBL28852881 | 0.64 | KIF11 (0.41) | — | |
| SCHEMBL241832 | 0.63 | CA1 (0.35) | — | |
| SCHEMBL19775398 | 0.63 | — | — | |
| SCHEMBL28255736 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0215733-B1 | PYRIDYLOXYPHENOXYPROPIONIC ACID DERIVATIVES | SANDOZ AG (CH) | 1989-06-21 | — | — | EP | claimed |
| WO-2023231312-A1 | NANOFILTRATION MEMBRANE PREPARATION METHOD, AND NANOFILTRATION MEMBRANE PREPARED THEREBY | 沃顿科技股份有限公司 | 2023-12-07 | — | — | WO | disclosed |