⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24819239 | 0.91 | — | — | |
| SCHEMBL19929708 | 0.68 | ALDH1A1 (0.33) | — | |
| SCHEMBL23665459 | 0.60 | — | — | |
| SCHEMBL11480902 | 0.57 | CYP2C9 (0.43) | — | |
| Biphenyl SCHEMBL5533056 | 0.57 | ALDH1A1 (0.45) | — | |
| SCHEMBL19929719 | 0.57 | MAPT (0.42) | — | |
| SCHEMBL11478446 | 0.56 | MEN1 (0.42) | — | |
| SCHEMBL11486850 | 0.56 | ALDH1A1 (0.33) | — | |
| SCHEMBL11589282 | 0.56 | CYP17A1 (0.40) | — | |
| SCHEMBL10439424 | 0.56 | MEN1 (0.48) | — |
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-2021143690-A1 | OSMIUM-CONTAINING CONJUGATED POLYMER, PREPARATION METHOD THEREFOR AND USE THEREOF | 厦门大学 | 2021-07-22 | — | — | WO | disclosed |