⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL15687714 | 1.00 | — | — | |
| Fluoride SCHEMBL169010 | 1.00 | — | — | |
| Fluoride SCHEMBL29034359 | 0.82 | — | — | |
| Fluoride SCHEMBL5140097 | 0.82 | — | — | |
| Fluoride SCHEMBL38465 | 0.71 | — | — | |
| Fluoride SCHEMBL9318976 | 0.71 | — | — | |
| F-18 SCHEMBL117749 | 0.71 | — | — | |
| Fluoride SCHEMBL32085 | 0.71 | — | — | |
| Fluoride SCHEMBL7924055 | 0.71 | — | — | |
| Fluoride SCHEMBL49263 | 0.71 | — | — |
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-20160038597-A9 | CARRIER THAT TARGETS FUCOSYLATED MOLECULE-PRODUCING CELLS | SAPPORO MEDICAL UNIVERSITY (JP) | 2016-02-11 | — | — | US | disclosed |