⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8724715 | 0.65 | — | — | |
| SCHEMBL8724721 | 0.65 | — | — | |
| SCHEMBL2378890 | 0.64 | — | — | |
| SCHEMBL5533369 | 0.61 | — | — | |
| SCHEMBL8726105 | 0.61 | — | — | |
| SCHEMBL518040 | 0.61 | — | — | |
| SCHEMBL4136640 | 0.61 | — | — | |
| SCHEMBL3342425 | 0.61 | — | — | |
| SCHEMBL3118013 | 0.61 | — | — | |
| SCHEMBL615135 | 0.61 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9096592-B2 | Bicyclic aza heterocycles, and use thereof | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2015-08-04 | — | — | US | disclosed |
| US-20140148433-A1 | BICYCLIC AZA HETEROCYCLES, AND USE THEREOF | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2014-05-29 | — | — | US | disclosed |
| US-20090192167-A1 | Insecticidal and fungicidal composition | MITSUI CHEMICALS, INC. (JP) | 2009-07-30 | — | — | US | disclosed |
| US-20090023667-A1 | Composition For Preventing Harmful Organisms | MITSUI CHEMICALS, INC. (JP) | 2009-01-22 | — | — | US | disclosed |
| EP-1938685-A1 | INSECTICIDAL AND BACTERICIDAL COMPOSITION | Mitsui Chemicals, Inc. (JP) | 2008-07-02 | — | — | EP | 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 |