⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13675428 | 0.91 | CARM1 (0.32) | — | |
| SCHEMBL13675449 | 0.90 | — | — | |
| SCHEMBL13675445 | 0.90 | EPHX1 (0.36) | — | |
| SCHEMBL3724615 | 0.88 | EPHX1 (0.39) | — | |
| SCHEMBL24181063 | 0.84 | ANPEP (0.31) | — | |
| SCHEMBL13675426 | 0.83 | — | — | |
| SCHEMBL8227004 | 0.78 | ANPEP (0.31) | — | |
| SCHEMBL13673868 | 0.75 | MEN1 (0.31) | — | |
| SCHEMBL14748063 | 0.74 | — | — | |
| SCHEMBL4983687 | 0.72 | ANPEP (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 |
|---|---|---|---|---|---|---|---|
| US-20090247519-A1 | AMINO-ETHYL-AMINO-ARYL (AEAA) COMPOUNDS AND THEIR USE | CANCER RESEARCH TECHNOLOGY LIMITED (GB) | 2009-10-01 | — | — | US | disclosed |