⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17812977 | 0.82 | — | — | |
| SCHEMBL20194041 | 0.81 | — | — | |
| SCHEMBL916110 | 0.81 | — | — | |
| SCHEMBL17728290 | 0.80 | CNR2 (0.33) | — | |
| SCHEMBL16114993 | 0.80 | — | — | |
| SCHEMBL17812300 | 0.79 | HDAC1 (0.38) | — | |
| SCHEMBL19601471 | 0.78 | — | — | |
| SCHEMBL15049008 | 0.78 | CNR2 (0.36) | — | |
| SCHEMBL24377910 | 0.77 | — | — | |
| SCHEMBL3020902 | 0.77 | DDR1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016050567-A1 | INSECTICIDAL CYANOTROPANE DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2016-04-07 | — | — | WO | disclosed |
| US-20160046620-A1 | METHODS OF CONTROLLING NEONICOTINOID RESISTANT PESTS | SYNGENTA LIMITED (GB) | 2016-02-18 | — | — | US | disclosed |
| EP-2978318-A1 | METHODS OF CONTROLLING NEONICOTINOID RESISTANT PESTS | Syngenta Participations AG (CH) | 2016-02-03 | — | — | EP | disclosed |
| WO-2014154487-A1 | METHODS OF CONTROLLING NEONICOTINOID RESISTANT PESTS | SYNGENTA PARTICIPATIONS AG (CH) | 2014-10-02 | — | — | WO | disclosed |