⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15386616 | 0.71 | — | — | |
| SCHEMBL10082514 | 0.70 | TSHR (0.33) | — | |
| SCHEMBL514835 | 0.65 | — | — | |
| SCHEMBL4736977 | 0.63 | USP2 (0.42) | — | |
| SCHEMBL18575908 | 0.62 | KDM4E (0.42) | — | |
| SCHEMBL245997 | 0.62 | — | — | |
| SCHEMBL6916037 | 0.62 | KDM4E (0.42) | — | |
| SCHEMBL1863468 | 0.62 | — | — | |
| Fluoride SCHEMBL776938 | 0.62 | — | — | |
| SCHEMBL972672 | 0.62 | ALDH1A1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1514542-B1 | Medicinal composition comprising Tacrine or Donepezil for improving brain function. | TOYAMA CHEMICAL CO LTD (JP) | 2012-02-22 | — | — | EP | claimed |