⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL322271 | 0.73 | — | — | |
| SCHEMBL1306466 | 0.70 | — | — | |
| SCHEMBL10874809 | 0.67 | — | — | |
| SCHEMBL29974 | 0.64 | — | — | |
| SCHEMBL36528 | 0.64 | — | — | |
| Phorone SCHEMBL23856063 | 0.64 | LMNA (0.39) | — | |
| SCHEMBL5081575 | 0.64 | — | — | |
| SCHEMBL9509929 | 0.64 | — | — | |
| SCHEMBL16232875 | 0.64 | — | — | |
| SCHEMBL9509932 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3347441-B1 | HYDROCARBON SOLUBLE/DISPERSIBLE HEMIFORMALS AS HYDROGEN SULFIDE SCAVENGERS | ECOLAB USA INC (US) | 2020-06-10 | — | — | EP | disclosed |
| US-10407626-B2 | Hydrocarbon soluble/dispersible hemiformals as hydrogen sulfide scavengers | ECOLAB USA INC. (US) | 2019-09-10 | — | — | US | disclosed |
| CN-108473528-A | High intensity sweetner | 赛诺米克斯公司 | 2018-08-31 | — | — | CN | disclosed |
| CN-108473484-A | Compounds useful as TRPM8 modulators | 赛诺米克斯公司 | 2018-08-31 | — | — | CN | disclosed |
| US-20170066977-A1 | HYDROCARBON SOLUBLE/DISPERSIBLE HEMIFORMALS AS HYDROGEN SULFIDE SCAVENGERS | ECOLAB USA INC. (US) | 2017-03-09 | — | — | US | disclosed |
| US-20150344404-A1 | PDK4 INHIBITOR AND USE THEREOF | THE KITASATO INSTITUTE (JP) | 2015-12-03 | — | — | US | disclosed |
| EP-2939668-A1 | PDK4 INHIBITOR AND USE THEREOF | The Kitasato Institute (JP) | 2015-11-04 | — | — | EP | disclosed |
| CN-1184219-C | Taxusane phosphonic oxygen methyl ether derivant | BRISTOL MYERS SQUIBB CO (US) | 2005-01-12 | — | — | CN | disclosed |
| CN-1037774-C | Phosphonooxymethyl ether derivatives of taxanes | BRISTOL MYERS SQUIBB CO (US) | 1998-03-18 | — | — | CN | disclosed |
| US-4914116-A | Nitrogen-containing heterocyclic compounds, and their use as insecticides | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1990-04-03 | — | — | US | disclosed |
| US-4847259-A | Nitrogen-containing heterocyclic compounds, and use as insecticide | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1989-07-11 | — | — | US | disclosed |
| US-4714706-A | JUVENILE HORMONE INHIBITORS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1987-12-22 | — | — | US | disclosed |
| EP-0203798-A2 | Nitrogen-containing heterocyclic compounds, and their production and use | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1986-12-03 | — | — | EP | disclosed |