⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1979240 | 0.71 | — | — | |
| SCHEMBL424369 | 0.71 | — | — | |
| SCHEMBL1239176 | 0.65 | — | — | |
| SCHEMBL705729 | 0.64 | — | — | |
| SCHEMBL1011490 | 0.57 | — | — | |
| SCHEMBL14087062 | 0.56 | — | — | |
| SCHEMBL9712194 | 0.56 | — | — | |
| SCHEMBL19673842 | 0.55 | — | — | |
| SCHEMBL3951139 | 0.54 | — | — | |
| SCHEMBL1133633 | 0.53 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1651234-B1 | COMBINATION OF MGLUR2 ANTAGONIST AND ACHE INHIBITOR FOR TREATMENT OF ACUTE AND/OR CHRONIC NEUROLOGICAL DISORDERS | HOFFMANN LA ROCHE (CH) | 2007-09-26 | — | — | EP | claimed |