⚠ 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 | |
|---|---|---|---|---|
| Guanidino Acetate SCHEMBL33971 | 0.69 | — | — | |
| SCHEMBL28248123 | 0.67 | — | — | |
| Guanidino Acetate SCHEMBL7467126 | 0.67 | — | — | |
| SCHEMBL23754357 | 0.67 | — | — | |
| SCHEMBL3724521 | 0.67 | — | — | |
| SCHEMBL220535 | 0.66 | — | — | |
| SCHEMBL4430721 | 0.65 | — | — | |
| SCHEMBL4431112 | 0.65 | — | — | |
| SCHEMBL4105724 | 0.65 | — | — | |
| SCHEMBL17027644 | 0.65 | HTT (0.41) | — |
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-2010138074-A1 | HYALURONIC ACID BASED DELIVERY SYSTEMS | HILBORN JOENS (SE) | 2010-12-02 | — | — | WO | disclosed |