⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4498709 | 0.75 | — | — | |
| SCHEMBL2946361 | 0.68 | CHRM2 (0.36) | — | |
| SCHEMBL6994973 | 0.68 | PDE7A (0.42) | — | |
| SCHEMBL8645554 | 0.68 | KMT2A (0.38) | — | |
| SCHEMBL8652013 | 0.67 | KMT2A (0.40) | — | |
| SCHEMBL3176738 | 0.66 | PDE7A (0.35) | — | |
| SCHEMBL12496896 | 0.65 | PDE7A (0.40) | — | |
| SCHEMBL9410107 | 0.65 | NPC1 (0.31) | — | |
| SCHEMBL1153876 | 0.64 | PDE7A (0.41) | — | |
| SCHEMBL2434247 | 0.63 | PDE7A (0.33) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1017674-B1 | UTILIZING SPIROCYCLIC PHENYL KETO-ENOLS AS PESTICIDES AND HERBICIDES | BAYER CROPSCIENCE AG (DE) | 2009-02-18 | — | — | EP | disclosed |
| US-6589976-B1 | Particularly effective wood preservation is achieved by impregnation processes on a large industrial scale, for example vacuum, a double vacuum or pressure processes. | BAYER AKTIENGESELLSCHAFT (DE) | 2003-07-08 | — | — | US | disclosed |
| EP-1017674-A1 | UTILIZING SPIROCYCLIC PHENYL KETO-ENOLS AS PESTICIDES AND HERBICIDES | Bayer Aktiengesellschaft (DE) | 2000-07-12 | — | — | EP | disclosed |
| WO-1999016748-A1 | UTILIZING SPIROCYCLIC PHENYL KETO-ENOLS AS PESTICIDES AND HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1999-04-08 | — | — | WO | disclosed |