⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL145266 | 1.00 | — | — | |
| SCHEMBL10141198 | 1.00 | — | — | |
| SCHEMBL115932 | 1.00 | — | — | |
| SCHEMBL19071 | 1.00 | — | — | |
| SCHEMBL7787365 | 1.00 | FDPS (0.41) | — | |
| Bromide SCHEMBL30667267 | 0.97 | — | — | |
| SCHEMBL28551663 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL3838019 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL31242999 | 0.97 | — | — | |
| Bromide SCHEMBL30667251 | 0.97 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20120035246-A1 | SINGLE-STRANDED NUCLEIC ACID MOLECULE HAVING NITROGEN-CONTAINING ALICYCLIC SKELETON | BONAC CORPORATION (JP) | 2012-02-09 | — | — | US | disclosed |