⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23905336 | 0.88 | DHODH (0.33) | — | |
| SCHEMBL23905731 | 0.84 | MAPT (0.35) | — | |
| SCHEMBL23904873 | 0.81 | — | — | |
| SCHEMBL23904851 | 0.79 | MCHR1 (0.34) | — | |
| SCHEMBL23905325 | 0.73 | MAPT (0.33) | — | |
| SCHEMBL23904788 | 0.72 | DPP4 (0.32) | — | |
| SCHEMBL26525880 | 0.72 | GRM2 (0.34) | — | |
| SCHEMBL26526002 | 0.72 | CHRNA1 (0.30) | — | |
| SCHEMBL23905385 | 0.70 | PGR (0.32) | — | |
| SCHEMBL23905463 | 0.69 | CFTR (0.32) | — |
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-2021198981-A1 | ANTIVIRAL COMPOUNDS AND USES THEREOF | Janssen Biopharma, Inc. (US) | 2021-10-07 | — | — | WO | disclosed |