⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9777713 | 0.92 | — | — | |
| SCHEMBL6796953 | 0.86 | — | — | |
| SCHEMBL127102 | 0.77 | — | — | |
| SCHEMBL11070616 | 0.77 | TSHR (0.50) | — | |
| SCHEMBL2467893 | 0.77 | — | — | |
| SCHEMBL8711357 | 0.76 | — | — | |
| SCHEMBL8444152 | 0.75 | — | — | |
| Fluoride SCHEMBL28481354 | 0.74 | TSHR (0.48) | — | |
| Ammonia Solution, Strong SCHEMBL21462229 | 0.74 | TSHR (0.48) | — | |
| Fluoride SCHEMBL29092358 | 0.74 | TSHR (0.48) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1885696-A1 | GLYCOSIDASE-INHIBITING IMINOSUGARS | Technische Universität Graz (AT) | 2008-02-13 | — | — | EP | claimed |
| WO-2006100586-A1 | GLYCOSIDASE-INHIBITING IMINOSUGARS | TECHNISCHE UNIVERSITÄT GRAZ (CH) | 2006-09-28 | — | — | WO | claimed |
| WO-2018010932-A1 | CATALYTIC CARBOXYLATION OF ACTIVATED ALKANES AND/OR OLEFINS | FUNDACIÓ INSTITUT CATALÀ D'INVESTIGACIÓ QUÍMICA (ES) | 2018-01-18 | — | — | WO | disclosed |
| EP-1885696-A1 | GLYCOSIDASE-INHIBITING IMINOSUGARS | Technische Universität Graz (AT) | 2008-02-13 | — | — | EP | disclosed |
| WO-2006100586-A1 | GLYCOSIDASE-INHIBITING IMINOSUGARS | TECHNISCHE UNIVERSITÄT GRAZ (CH) | 2006-09-28 | — | — | WO | disclosed |