⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22783601 | 0.89 | GLRA1 (0.32) | — | |
| SCHEMBL13695158 | 0.83 | GLRA1 (0.41) | — | |
| SCHEMBL6242798 | 0.80 | CYP1A2 (0.44) | — | |
| SCHEMBL8007867 | 0.80 | MGAM (0.50) | — | |
| SCHEMBL3121478 | 0.80 | GLRA1 (0.39) | — | |
| SCHEMBL10403217 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL7675204 | 0.78 | HTR2C (0.38) | — | |
| Hydrochloric Acid SCHEMBL7675200 | 0.78 | HTR2C (0.38) | — | |
| SCHEMBL419447 | 0.78 | — | — | |
| SCHEMBL682 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110573602-B | Liquid detergent composition for hard surface | 花王株式会社 | 2021-11-12 | — | — | CN | disclosed |
| US-10703746-B2 | Mutant IDH1 inhibitors useful for treating cancer | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2020-07-07 | — | — | US | disclosed |
| CN-110573602-A | Liquid detergent composition for hard surface | 花王株式会社 | 2019-12-13 | — | — | CN | disclosed |
| EP-1537230-A4 | FLUORESCENT ENZYME ASSAY METHODS AND COMPOSITIONS | APPLERA CORP (US) | 2008-06-18 | — | — | EP | disclosed |
| CN-1856566-A | Antirust oil water separation type detergent composition and method of cleaning | NICCA CHEMICAL CO (JP) | 2006-11-01 | — | — | CN | disclosed |
| CN-1627076-A | Monoclonal antibody for identifying glycine-N-methyltransferase and application of using method thereof | JINGYAN BIOCHEMICAL TECH CO LT (CN) | 2005-06-15 | — | — | CN | disclosed |
| EP-1537230-A1 | FLUORESCENT ENZYME ASSAY METHODS AND COMPOSITIONS | Applera Corporation (US) | 2005-06-08 | — | — | EP | disclosed |
| WO-2004022773-A1 | FLUORESCENT ENZYME ASSAY METHODS AND COMPOSITIONS | APPLERA CORPORATION (US) | 2004-03-18 | — | — | WO | disclosed |
| US-4216226-A | GLYCINE DERIVATIVE | MEIJI SEIKA KAISHA, LTD. (JP) | 1980-08-05 | — | — | US | disclosed |