⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4440350 | 0.69 | — | — | |
| SCHEMBL3945027 | 0.69 | — | — | |
| SCHEMBL7494444 | 0.69 | — | — | |
| SCHEMBL2546251 | 0.69 | — | — | |
| SCHEMBL1706184 | 0.64 | — | — | |
| SCHEMBL1445441 | 0.60 | — | — | |
| SCHEMBL1445443 | 0.60 | — | — | |
| SCHEMBL1685089 | 0.55 | — | — | |
| SCHEMBL22346244 | 0.55 | — | — | |
| SCHEMBL10276 | 0.46 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20090023667-A1 | Composition For Preventing Harmful Organisms | MITSUI CHEMICALS, INC. (JP) | 2009-01-22 | — | — | US | disclosed |
| EP-1872658-A1 | PESTICIDAL COMPOSITION | Mitsui Chemicals, Inc. (JP) | 2008-01-02 | — | — | EP | disclosed |
| US-20070049635-A1 | Diamine derivatives, process for producing the same, and plant disease control agents containing the same as active ingredients | MITSUI CHEMICALS, INC. (JP) | 2007-03-01 | — | — | US | disclosed |
| EP-1681285-A1 | DIAMINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND PLANT DISEASE CONTROL AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT | Mitsui Chemicals, Inc. (JP) | 2006-07-19 | — | — | EP | disclosed |