⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2840847 | 0.97 | — | — | |
| SCHEMBL974911 | 0.75 | TSHR (0.36) | — | |
| SCHEMBL4793302 | 0.75 | — | — | |
| SCHEMBL22761741 | 0.75 | — | — | |
| SCHEMBL6223484 | 0.72 | — | — | |
| SCHEMBL16611562 | 0.72 | — | — | |
| SCHEMBL9551832 | 0.72 | — | — | |
| SCHEMBL9780351 | 0.72 | — | — | |
| SCHEMBL10832324 | 0.70 | — | — | |
| SCHEMBL6387713 | 0.70 | NPSR1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4161524-A | INSECTICIDES, MITICIDES, NEMATOCIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1979-07-17 | — | — | US | disclosed |
| US-4150155-A | INSECTICIDES, NEMATOCIDES, MITICIDES | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1979-04-17 | — | — | US | disclosed |
| US-4134979-A | INSECTICIDES, MITICIDES, NEMATOCIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1979-01-16 | — | — | US | disclosed |