⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9522276 | 0.61 | — | — | |
| SCHEMBL18352708 | 0.58 | — | — | |
| SCHEMBL3892340 | 0.57 | — | — | |
| SCHEMBL5471187 | 0.56 | — | — | |
| SCHEMBL17801732 | 0.55 | KDM4E (0.32) | — | |
| SCHEMBL17541720 | 0.52 | — | — | |
| SCHEMBL10028953 | 0.52 | — | — | |
| SCHEMBL31662773 | 0.51 | — | — | |
| SCHEMBL1015818 | 0.49 | — | — | |
| SCHEMBL255876 | 0.47 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100331310-A1 | BICYCLOAMINE DERIVATIVES | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2010-12-30 | — | — | US | disclosed |
| US-4322422-A | Oxalylated amidinohydrazones, method for preparing same and use as insect and fire ant control agents | AMERICAN CYANAMID CO. (US) | 1982-03-30 | — | — | US | disclosed |