⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10456883 | 0.79 | — | — | |
| SCHEMBL2143465 | 0.79 | — | — | |
| SCHEMBL53946 | 0.79 | — | — | |
| SCHEMBL1168 | 0.79 | — | — | |
| SCHEMBL10489172 | 0.79 | — | — | |
| SCHEMBL18916 | 0.79 | — | — | |
| SCHEMBL2143459 | 0.79 | — | — | |
| SCHEMBL6060607 | 0.79 | — | — | |
| SCHEMBL2143464 | 0.79 | — | — | |
| Water SCHEMBL23524663 | 0.72 | — | — |
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-1991010641-A1 | A PROCESS FOR THE PREPARATION OF AMINES | BEROL NOBEL AB (SE) | 1991-07-25 | — | — | WO | disclosed |