⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL186025 | 0.81 | ALDH1A1 (0.31) | — | |
| SCHEMBL86346 | 0.81 | ALDH1A1 (0.31) | — | |
| SCHEMBL1654390 | 0.81 | ALDH1A1 (0.31) | — | |
| SCHEMBL6309094 | 0.81 | ALDH1A1 (0.31) | — | |
| SCHEMBL31316344 | 0.77 | — | — | |
| SCHEMBL24434310 | 0.74 | — | — | |
| SCHEMBL3182780 | 0.74 | — | — | |
| SCHEMBL22624044 | 0.74 | — | — | |
| SCHEMBL1090703 | 0.74 | — | — | |
| SCHEMBL13605455 | 0.74 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220153668-A1 | COMPOSITION | MEXICHEM FLUOR S.A. DE C.V. (MX) | 2022-05-19 | — | — | US | disclosed |
| US-5827611-A | Multilayered thermoplastic article with special properties | HOECHST CELANESE CORP (US) | 1998-10-27 | — | — | US | disclosed |
| EP-0606598-A2 | Shaped articles of graduated refractive index exhibiting low dispersion | HOECHST CELANESE CORPORATION (US) | 1994-07-20 | — | — | EP | disclosed |
| WO-1994015005-A1 | SHAPED ARTICLES OF GRADUATED REFRACTIVE INDEX | HOECHST CELANESE CORPORATION (US) | 1994-07-07 | — | — | WO | disclosed |
| US-5319131-A | Reacting dimethyl 2-fluoromalonate with formaldehyde to form hydroxymethylated dimethyl 2-flurormalonate, hydrolysis, decarboxylation, dehydration then esterification with a hexafluoroalkylol | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-06-07 | — | — | US | disclosed |
| US-5301254-A | Beam waveguide; sheath of polymer of tetrafluoroethylene and a perfluorovinyl ether monomer | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-04-05 | — | — | US | disclosed |
| US-5283303-A | Optionally deuterated; high glass transition temperature; used in manufacture of waveguides | HOECHST AKTIENGESELLSCHAFT (DE) | 1994-02-01 | — | — | US | disclosed |
| US-5198925-A | α-fluoroacrylic acid esters and polymers thereof | HOECHST AKTIENGESELLSCHAFT | 1993-03-30 | — | — | US | disclosed |
| US-5175790-A | Waveguides for long distance transmission, high temperature continuous use | HOECHST AKTIENGESELLSCHAFT (DE) | 1992-12-29 | — | — | US | disclosed |