⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23958528 | 0.85 | GRIN2D (0.31) | — | |
| SCHEMBL24443616 | 0.85 | GRIN2D (0.33) | — | |
| SCHEMBL23958527 | 0.69 | GRIN2D (0.36) | — | |
| SCHEMBL12672679 | 0.65 | ADH1A (0.32) | — | |
| SCHEMBL27389259 | 0.62 | PIK3CD (0.33) | — | |
| SCHEMBL19333339 | 0.62 | ADH1A (0.37) | — | |
| SCHEMBL986680 | 0.59 | — | — | |
| SCHEMBL14175020 | 0.59 | — | — | |
| SCHEMBL12344858 | 0.59 | — | — | |
| SCHEMBL5948626 | 0.59 | TSHR (0.36) | — |
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-2022140744-A1 | ESTROGEN RECEPTOR MODULATORS | RECURIUM IP HOLDINGS, LLC (US) | 2022-06-30 | — | — | WO | disclosed |