⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23704877 | 0.81 | BACE1 (0.39) | — | |
| SCHEMBL23704847 | 0.77 | RARB (0.43) | — | |
| SCHEMBL23463196 | 0.68 | PGR (0.33) | — | |
| SCHEMBL23714629 | 0.65 | PDK2 (0.36) | — | |
| SCHEMBL19810469 | 0.63 | AKR1B1 (0.37) | — | |
| SCHEMBL23704862 | 0.63 | BACE1 (0.35) | — | |
| SCHEMBL1755966 | 0.62 | HTR2A (0.36) | — | |
| SCHEMBL13369134 | 0.61 | RXRA (0.44) | — | |
| SCHEMBL19827951 | 0.61 | ADRA2A (0.32) | — | |
| SCHEMBL23705335 | 0.60 | CA12 (0.42) | — |
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-2021155316-A1 | COMPOUNDS AND USES THEREOF | FOGHORN THERAPEUTICS INC. (US) | 2021-08-05 | — | — | WO | disclosed |