⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10944966 | 1.00 | — | — | |
| SCHEMBL10944954 | 1.00 | — | — | |
| SCHEMBL5888749 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL10947905 | 0.98 | GABRP (0.48) | — | |
| Hydrochloric Acid SCHEMBL10947899 | 0.98 | GABRP (0.48) | — | |
| Hydrochloric Acid SCHEMBL10947887 | 0.98 | GABRP (0.48) | — | |
| SCHEMBL23849939 | 0.78 | — | — | |
| SCHEMBL10409045 | 0.78 | — | — | |
| SCHEMBL1225631 | 0.76 | GABRP (0.50) | — | |
| SCHEMBL8565158 | 0.76 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1416794-A4 | REGULATION OF PLANT FERTILITY BY MODULATION OF GABA LEVELS IN FLOWERS | UNIV CHICAGO (US) | 2005-06-01 | — | — | EP | claimed |
| US-20040177398-A1 | Regulation of plant fertility by modulation of GABA levels in flowers | CHICAGO, THE UNIVERSITY OF | 2004-09-09 | — | — | US | claimed |
| EP-1416794-A2 | REGULATION OF PLANT FERTILITY BY MODULATION OF GABA LEVELS IN FLOWERS | The University of Chicago (US) | 2004-05-12 | — | — | EP | claimed |
| WO-2003000039-A2 | REGULATION OF PLANT FERTILITY BY MODULATION OF GABA LEVELS IN FLOWERS | UNIVERSITY OF CHICAGO (US) | 2003-01-03 | — | — | WO | claimed |
| CN-114867714-A | Fluoro substituted cyclohexene analogues of gamma-aminobutyric acid (GABA) | 西北大学 | 2022-08-05 | — | — | CN | disclosed |
| US-7109149-B2 | Regulation of plant fertility by modulation of GABA levels in flowers | THE UNIVERSITY OF CHICAGO (US) | 2006-09-19 | — | — | US | disclosed |
| EP-1416794-A4 | REGULATION OF PLANT FERTILITY BY MODULATION OF GABA LEVELS IN FLOWERS | UNIV CHICAGO (US) | 2005-06-01 | — | — | EP | disclosed |
| US-20040177398-A1 | Regulation of plant fertility by modulation of GABA levels in flowers | CHICAGO, THE UNIVERSITY OF | 2004-09-09 | — | — | US | disclosed |
| EP-1416794-A2 | REGULATION OF PLANT FERTILITY BY MODULATION OF GABA LEVELS IN FLOWERS | The University of Chicago (US) | 2004-05-12 | — | — | EP | disclosed |
| WO-2003000039-A2 | REGULATION OF PLANT FERTILITY BY MODULATION OF GABA LEVELS IN FLOWERS | UNIVERSITY OF CHICAGO (US) | 2003-01-03 | — | — | WO | disclosed |
| US-4528028-A | Use of certain halogen-containing amino-acid compounds for controlling the growth of unwanted plants | E.I. DU PONT DE NEMOURS AND COMPANY | 1985-07-09 | — | — | US | disclosed |