⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14802384 | 1.00 | — | — | |
| SCHEMBL12603039 | 0.83 | HRH4 (0.39) | — | |
| SCHEMBL9285404 | 0.82 | — | — | |
| SCHEMBL10065935 | 0.82 | CYP19A1 (0.42) | — | |
| SCHEMBL18377719 | 0.80 | GBA1 (0.41) | — | |
| Ammonia Solution, Strong SCHEMBL28483640 | 0.80 | CYP19A1 (0.41) | — | |
| SCHEMBL24023176 | 0.78 | — | — | |
| SCHEMBL20806029 | 0.78 | — | — | |
| SCHEMBL1753962 | 0.78 | GBA1 (0.45) | — | |
| SCHEMBL19147470 | 0.78 | — | — |
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-20150126708-A1 | RADIOFLUORINATION METHOD | IMPERIAL INNOVATIONS LIMITED (GB) | 2015-05-07 | — | — | US | disclosed |