⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2113897 | 0.91 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL1948565 | 0.81 | — | — | |
| SCHEMBL1948256 | 0.68 | — | — | |
| SCHEMBL698901 | 0.68 | — | — | |
| SCHEMBL1950447 | 0.67 | — | — | |
| SCHEMBL1946925 | 0.65 | — | — | |
| SCHEMBL1949205 | 0.64 | — | — | |
| SCHEMBL1950409 | 0.64 | — | — | |
| SCHEMBL2112421 | 0.58 | — | — | |
| SCHEMBL698150 | 0.56 | NR1H2 (0.42) | — |
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-9101135-B2 | Agricultural/horticultural insecticide and method for using the same | MITSUI CHEMICALS, INC. (JP) | 2015-08-11 | — | — | US | disclosed |
| US-9089133-B2 | Insecticide for agricultural or horticultural use and method of use thereof | MITSUI CHEMICALS, INC. (JP) | 2015-07-28 | — | — | US | disclosed |
| US-20140303377-A1 | AGRICULTURAL/HORTICULTURAL INSECTICIDE AND METHOD FOR USING THE SAME | MITSUI CHEMICALS, INC. (JP) | 2014-10-09 | — | — | US | disclosed |
| US-8816128-B2 | Insecticide for agricultural or horticultural use and method of use thereof | MITSUI CHEMICALS, INC. (JP) | 2014-08-26 | — | — | US | disclosed |
| US-20130066114-A1 | INSECTICIDE FOR AGRICULTURAL OR HORTICULTURAL USE AND METHOD OF USE THEREOF | MITSUI CHEMICALS, INC. (JP) | 2013-03-14 | — | — | US | disclosed |
| US-20120220802-A1 | INSECTICIDE FOR AGRICULTURAL OR HORTICULTURAL USE AND METHOD OF USE THEREOF | MITSUI CHEMICALS, INC. (JP) | 2012-08-30 | — | — | US | disclosed |
| US-8158814-B2 | Insecticide for agricultural or horticultural use and method of use thereof | MITSUI CHEMICALS, INC. (JP) | 2012-04-17 | — | — | US | disclosed |
| US-20070027154-A1 | Insecticide for agricultural or horticultural use and method of use thereof | MITSUI CHEMICALS., INC. (JP) | 2007-02-01 | — | — | US | disclosed |