⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL307359 | 0.70 | — | — | |
| SCHEMBL1478488 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL526048 | 0.67 | — | — | |
| SCHEMBL9971058 | 0.67 | — | — | |
| SCHEMBL22442 | 0.67 | — | — | |
| SCHEMBL7828584 | 0.67 | — | — | |
| Water SCHEMBL1971739 | 0.67 | — | — | |
| SCHEMBL1932405 | 0.67 | — | — | |
| SCHEMBL2305364 | 0.67 | — | — | |
| Bromide SCHEMBL11505136 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006032504-A2 | METHOD FOR INTRODUCING GENETIC MUTATIONS INTO PLANT CELLS | VRIJE UNIVERSITEIT BRUSSEL (BE) | 2006-03-30 | — | — | WO | disclosed |