⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7179192 | 0.75 | — | — | |
| SCHEMBL2532017 | 0.69 | — | — | |
| SCHEMBL12827025 | 0.67 | — | — | |
| SCHEMBL11019013 | 0.67 | — | — | |
| SCHEMBL13804967 | 0.67 | — | — | |
| SCHEMBL11089960 | 0.67 | — | — | |
| SCHEMBL3950493 | 0.63 | — | — | |
| SCHEMBL1616586 | 0.62 | — | — | |
| SCHEMBL3075677 | 0.61 | — | — | |
| SCHEMBL1461410 | 0.58 | — | — |
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-109553594-A | A kind of preparation method of tetrahydrofuran -3- formaldehyde | 山东新和成药业有限公司 | 2019-04-02 | — | — | CN | disclosed |
| CN-108864003-A | A kind of preparation method of imrecoxib intermediate and imrecoxib | 江苏美迪克化学品有限公司 | 2018-11-23 | — | — | CN | disclosed |
| EP-3350245-A1 | AMINE FOR LOW-EMISSION EPOXY RESIN COMPOSITIONS | Sika Technology AG (CH) | 2018-07-25 | — | — | EP | disclosed |
| CN-108137549-A | FXIA inhibitor derived from novel substituted glycine | 百时美施贵宝公司 | 2018-06-08 | — | — | CN | disclosed |
| CN-105010342-B | Method for using 3-aryl-5-methylbutyrolactone compounds as plant pathogenic fungus killing agent | 河北工业大学 | 2017-05-03 | — | — | CN | disclosed |
| WO-2017046292-A1 | AMINE FOR LOW-EMISSION EPOXY RESIN COMPOSITIONS | SIKA TECHNOLOGY AG (CH) | 2017-03-23 | — | — | WO | disclosed |
| CN-101382615-A | Polymer film, polaroid protective film, polaroid and liquid crystal display unit | FUJIFILM CORP (JP) | 2009-03-11 | — | — | CN | disclosed |
| EP-1549682-A1 | POLYMERS CONTAINING SILANE | Wacker Polymer Systems GmbH & Co. KG (DE) | 2005-07-06 | — | — | EP | disclosed |
| WO-2004013187-A1 | POLYMERS CONTAINING SILANE | WACKER POLYMER SYSTEMS GMBH & CO. KG (DE) | 2004-02-12 | — | — | WO | disclosed |
| EP-0673309-A4 | BIAXIALLY ORIENTED PENBB FILM PRIMED WITH RADIATION CURABLE COATING COMPOSITION. | HOECHST AG (DE) | 1995-12-06 | — | — | EP | disclosed |
| EP-0673309-A1 | BIAXIALLY ORIENTED PENBB FILM PRIMED WITH RADIATION CURABLE COATING COMPOSITION | HOECHST AKTIENGESELLSCHAFT (DE) | 1995-09-27 | — | — | EP | disclosed |
| WO-1994013467-A1 | BIAXIALLY ORIENTED PENBB FILM PRIMED WITH RADIATION CURABLE COATING COMPOSITION | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-06-23 | — | — | WO | disclosed |
| EP-0355544-A2 | Substituted decalin amines, method for their preparation and their use in pesticides | BAYER AG (DE) | 1990-02-28 | — | — | EP | disclosed |