⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23304737 | 1.00 | — | — | |
| SCHEMBL29758589 | 1.00 | — | — | |
| SCHEMBL31059132 | 0.80 | DRD2 (0.36) | — | |
| SCHEMBL23304967 | 0.80 | DRD2 (0.36) | — | |
| SCHEMBL29914274 | 0.80 | DRD2 (0.36) | — | |
| SCHEMBL31059133 | 0.80 | CHRNA7 (0.30) | — | |
| SCHEMBL23304906 | 0.80 | CHRNA7 (0.30) | — | |
| SCHEMBL23304784 | 0.76 | HTR2C (0.30) | — | |
| SCHEMBL31059143 | 0.76 | HTR2C (0.30) | — | |
| SCHEMBL29758560 | 0.76 | HTR2C (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114929709-B | Spirocyclic O-glycoprotein-2-acetamido-2-deoxy-3-D-glucopyranoside inhibitors | 比奥根MA公司 | 2024-08-30 | — | — | CN | disclosed |