⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8664014 | 0.76 | MAPT (0.34) | — | |
| SCHEMBL6988844 | 0.73 | HTT (0.30) | — | |
| SCHEMBL8664006 | 0.73 | ALDH1A1 (0.38) | — | |
| SCHEMBL27890788 | 0.71 | LMNA (0.47) | — | |
| SCHEMBL38157 | 0.71 | — | — | |
| SCHEMBL14465255 | 0.70 | — | — | |
| SCHEMBL27430163 | 0.69 | ENPEP (0.37) | — | |
| Hydrochloric Acid SCHEMBL6338625 | 0.69 | LMNA (0.44) | — | |
| SCHEMBL3589092 | 0.68 | HTT (0.31) | — | |
| SCHEMBL311383 | 0.67 | OR51E2 (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 |
|---|---|---|---|---|---|---|---|
| EP-0643037-B1 | Ester compound, active agent for controlling noxious insect pests containing the same as active ingredient, intermediate for production of the ester compound, and process for producing the intermediate | SUMITOMO CHEMICAL CO (JP) | 1998-05-06 | — | — | EP | disclosed |
| US-5672779-A | INTERMEDIATE FOR PESTICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-09-30 | — | — | US | disclosed |
| US-5550258-A | INSECTICIDES, MITICIDES, NEMATOCIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1996-08-27 | — | — | US | disclosed |
| EP-0643037-A1 | Ester compound, active agent for controlling noxious insect pests containing the same as active ingredient, intermediate for production of the ester compound, and process for producing the intermediate | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1995-03-15 | — | — | EP | disclosed |