⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13285771 | 0.78 | MAPT (0.40) | — | |
| Water SCHEMBL28018801 | 0.74 | CES2 (0.41) | — | |
| SCHEMBL1728211 | 0.72 | — | — | |
| SCHEMBL28222178 | 0.72 | — | — | |
| SCHEMBL35399 | 0.72 | — | — | |
| SCHEMBL9799878 | 0.72 | — | — | |
| SCHEMBL146641 | 0.71 | — | — | |
| SCHEMBL8619874 | 0.70 | MAPT (0.42) | — | |
| SCHEMBL8195816 | 0.70 | ALDH1A1 (0.41) | — | |
| SCHEMBL11668383 | 0.69 | KEAP1 (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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110317174-A | Hydrogen barrier, hydrogen barrier film, which are formed, uses composition, hydrogen barrier film, the manufacturing method of hydrogen barrier film and electronic component | 东京应化工业株式会社 | 2019-10-11 | — | — | CN | disclosed |
| CN-108375878-A | The manufacturing method and cured film of polymerizable composition, polymerizable composition, cured film | 东京应化工业株式会社 | 2018-08-07 | — | — | CN | disclosed |
| CN-105165831-A | Controlling Red Rice With Mesotrione | FMC CORP | 2015-12-23 | — | — | CN | disclosed |
| CN-1044661-C | Pesticides, insecticides, miticides and nematocides compositions containing new silanes derivatives | HOECHST AG (DE) | 1999-08-18 | — | — | CN | disclosed |
| CN-1032005-C | Novel silane derivatives, formulations containing them and their use as pesticides | HOECHST AG (DE) | 1996-06-12 | — | — | CN | disclosed |
| CN-1025501-C | Process for preparing silane derivatives | HOECHST AG (DE) | 1994-07-20 | — | — | CN | disclosed |
| CN-1077588-A | The agricultural chemicals, insecticide, the acaricidal nematicidal agent composition that contain novel silane derivs | HOECHST AG (DE) | 1993-10-27 | — | — | CN | disclosed |
| US-4990621-A | Insecticides, miticides and nematocides; 3-(3-fluoro-4-phenoxyphenyl, 3-(5-fluoro-3-phenoxypyrid-2-yl) or 3-(3-methyl-4-phenyl prop-1-ene | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-02-05 | — | — | US | disclosed |
| EP-0224024-B1 | SILANE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AGENTS CONTAINING THEM AND THEIR USE AS PESTICIDES | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-06-20 | — | — | EP | disclosed |
| CN-86107292-A | Novel silane derivatives, process for their preparation, formulations containing them and their use as pesticides | — | 1987-07-29 | — | — | CN | disclosed |
| US-4599362-A | 2-aryl-ethyl ether derivatives and insecticidal and acaricidal agents containing said derivatives | MITSUITOATSU CHEMICALS, INC. (JP) | 1986-07-08 | — | — | US | disclosed |
| US-4570005-A | REACTING THE ARYL PROPYL CHLORIDE WITH THE CORRESPONDING ARYL ALCOHOL OR ARYL MERCAPTAN | MITSUITOATSU CHEMICALS INC. (JP) | 1986-02-11 | — | — | US | disclosed |
| US-4397864-A | LOW TOXICITY | MITSUITOATSU CHEMICALS INC. (JP) | 1983-08-09 | — | — | US | disclosed |