⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10695680 | 0.81 | — | — | |
| SCHEMBL16994166 | 0.79 | — | — | |
| SCHEMBL20962929 | 0.76 | GRIK1 (0.38) | — | |
| SCHEMBL48911 | 0.72 | — | — | |
| SCHEMBL4579900 | 0.72 | — | — | |
| SCHEMBL982687 | 0.72 | — | — | |
| SCHEMBL50404 | 0.72 | — | — | |
| SCHEMBL4577050 | 0.72 | — | — | |
| SCHEMBL4577938 | 0.72 | — | — | |
| SCHEMBL13036241 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0938492-A1 | COMBINATORIAL SYNTHESIS OF CARBOHYDRATE LIBRARIES | SYNSORB Biotech Inc. (CA) | 1999-09-01 | — | — | EP | disclosed |
| WO-1998022487-A1 | COMBINATORIAL SYNTHESIS OF CARBOHYDRATE LIBRARIES | SYNSORB BIOTECH, INC. (CA) | 1998-05-28 | — | — | WO | disclosed |