⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8197945 | 1.00 | — | — | |
| SCHEMBL19886275 | 0.78 | — | — | |
| SCHEMBL446126 | 0.78 | — | — | |
| SCHEMBL3578089 | 0.72 | — | — | |
| SCHEMBL23170315 | 0.71 | — | — | |
| SCHEMBL2566993 | 0.69 | — | — | |
| SCHEMBL13174488 | 0.69 | — | — | |
| SCHEMBL9630370 | 0.69 | — | — | |
| SCHEMBL2566989 | 0.69 | — | — | |
| SCHEMBL13618606 | 0.68 | — | — |
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-6111056-A | Cyclic amine based polymers and process for their production | BASF AKTIENGESELLSCHAFT (DE) | 2000-08-29 | — | — | US | disclosed |