⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL404043 | 0.75 | — | — | |
| SCHEMBL404044 | 0.75 | — | — | |
| SCHEMBL4929111 | 0.74 | SLC6A2 (0.36) | — | |
| SCHEMBL3500359 | 0.74 | — | — | |
| SCHEMBL2375307 | 0.74 | — | — | |
| SCHEMBL11619528 | 0.71 | — | — | |
| SCHEMBL467469 | 0.70 | — | — | |
| SCHEMBL14514232 | 0.70 | — | — | |
| SCHEMBL18535130 | 0.70 | — | — | |
| SCHEMBL1291214 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20070105924-A1 | Vigabatrin bioisoteres and related methods of use | NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR | 2007-05-10 | — | — | US | disclosed |
| WO-2007035964-A2 | VIGABATRIN BIOISOTERES AND RELATED METHODS OF USE | NORTHWESTERN UNIVERSITY (US) | 2007-03-29 | — | — | WO | disclosed |