⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14750790 | 0.70 | — | — | |
| Alcohol SCHEMBL463 | 0.65 | — | — | |
| Alcohol SCHEMBL17770701 | 0.65 | — | — | |
| SCHEMBL217230 | 0.65 | — | — | |
| Alcohol SCHEMBL2464657 | 0.65 | TSHR (1.00) | — | |
| Alcohol SCHEMBL9461084 | 0.65 | TSHR (1.00) | — | |
| Alcohol SCHEMBL6910520 | 0.65 | TSHR (1.00) | — | |
| Alcohol SCHEMBL54946 | 0.65 | — | — | |
| Alcohol SCHEMBL2023653 | 0.65 | — | — | |
| Alcohol SCHEMBL18321789 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3428202-A1 | PROCESS OF PRODUCING POLYOLEFINS USING METALLOCENE POLYMERIZATION CATALYSTS AND COPOLYMERS THEREFROM | ExxonMobil Chemical Patents Inc. (US) | 2019-01-16 | — | — | EP | claimed |