⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23665404 | 0.91 | — | — | |
| SCHEMBL19929708 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL23665459 | 0.67 | — | — | |
| Biphenyl SCHEMBL5533056 | 0.63 | ALDH1A1 (0.45) | — | |
| SCHEMBL19929719 | 0.63 | MAPT (0.42) | — | |
| SCHEMBL10439424 | 0.61 | MEN1 (0.48) | — | |
| SCHEMBL19929706 | 0.61 | MEN1 (0.33) | — | |
| Hydroquinone SCHEMBL9718524 | 0.61 | NPC1 (0.42) | — | |
| SCHEMBL27697273 | 0.60 | NPC1 (0.37) | — | |
| SCHEMBL39635 | 0.59 | — | — |
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-20220416167-A1 | OSMIUM-CONTAINING CONJUGATED POLYMER AND METHODS THEREOF | XIAMEN UNIVERSITY (CN) | 2022-12-29 | — | — | US | disclosed |