⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25154181 | 0.70 | — | — | |
| SCHEMBL21077868 | 0.69 | — | — | |
| SCHEMBL17793873 | 0.68 | — | — | |
| SCHEMBL18599728 | 0.68 | — | — | |
| SCHEMBL18685633 | 0.67 | — | — | |
| SCHEMBL24604642 | 0.67 | GRIK1 (0.31) | — | |
| SCHEMBL10001075 | 0.67 | — | — | |
| SCHEMBL19072532 | 0.67 | TRPA1 (0.33) | — | |
| SCHEMBL21319806 | 0.66 | — | — | |
| SCHEMBL21998700 | 0.66 | — | — |
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-3689868-A1 | TETRAHYDRONAPHTHALENE AND TETRAHYDROISOQUINOLINE DERIVATIVES AS ESTROGEN RECEPTOR DEGRADERS | Arvinas Operations, Inc. (US) | 2020-08-05 | — | — | EP | disclosed |