⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14350983 | 1.00 | — | — | |
| SCHEMBL8925197 | 1.00 | — | — | |
| SCHEMBL14397173 | 0.97 | KDM1A (0.48) | — | |
| SCHEMBL562702 | 0.85 | KDM1A (0.63) | — | |
| SCHEMBL562701 | 0.85 | KDM1A (0.63) | — | |
| SCHEMBL15884022 | 0.84 | KDM1A (0.75) | — | |
| SCHEMBL12951512 | 0.82 | KDM1A (0.60) | — | |
| SCHEMBL12082977 | 0.82 | KDM1A (0.60) | — | |
| SCHEMBL4031564 | 0.79 | — | — | |
| SCHEMBL16409482 | 0.77 | — | — |
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-5599847-A | N,N,N',N'-TETRAALKYL-1,4-DIAMINO OR N,N' -DIAMIDINO-1,4-DIAMINOBUT-2-ENES; MILDEW; PLANTS | BRITISH TECHNOLOGY GROUP LIMITED (GB) | 1997-02-04 | — | — | US | disclosed |