⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4019339 | 0.91 | — | — | |
| SCHEMBL28024649 | 0.88 | — | — | |
| SCHEMBL2767830 | 0.80 | — | — | |
| SCHEMBL132364 | 0.79 | TSHR (0.67) | — | |
| SCHEMBL180666 | 0.79 | — | — | |
| SCHEMBL496221 | 0.76 | TSHR (0.72) | — | |
| SCHEMBL2154814 | 0.76 | TSHR (0.72) | — | |
| SCHEMBL494288 | 0.76 | TSHR (0.72) | — | |
| SCHEMBL2154041 | 0.76 | TSHR (0.72) | — | |
| Hydrochloric Acid SCHEMBL7947881 | 0.76 | TSHR (0.63) | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120040379-A | Method for synthesizing photoinitiator 389 | 兰州大学 | 2025-05-27 | — | — | CN | claimed |
| CN-101993358-A | A process for producing 4-(4-halo-1-oxybutyl)-alpha,alpha-dimethylbenzene acetic acid or alkyl esters thereof | JUBILANT ORGANOSYS LTD | 2011-03-30 | — | — | CN | claimed |
| EP-2289867-A2 | A process for producing 4-(4-halo-1-oxybutyl)-alpha,alpha-dimethylbenzene acetic acid or alkyl esters thereof | Jubilant Organosys Limited (IN) | 2011-03-02 | — | — | EP | claimed |
| CN-120040379-A | Method for synthesizing photoinitiator 389 | 兰州大学 | 2025-05-27 | — | — | CN | disclosed |
| CN-115715219-A | Water soluble, modified amino acid derivatives for the treatment of neurological diseases and selected psychiatric disorders | 雅盖隆大学 | 2023-02-24 | — | — | CN | disclosed |
| CN-114588278-A | fluorescence-CT bimodal molecular probe, preparation method and application thereof | 康达洲际医疗器械有限公司 | 2022-06-07 | — | — | CN | disclosed |
| US-10056638-B2 | Phosphonium cations and polymers incorporating them | UNIVERSITY OF DELAWARE (US) | 2018-08-21 | — | — | US | disclosed |
| US-20170149080-A1 | PHOSPHONIUM CATIONS AND POLYMERS INCORPORATING THEM | UNIVERSITY OF DELAWARE (US) | 2017-05-25 | — | — | US | disclosed |
| US-20170149080-A1 | PHOSPHONIUM CATIONS AND POLYMERS INCORPORATING THEM | UNIVERSITY OF DELAWARE (US) | 2017-05-25 | — | — | US | disclosed |
| US-20170149080-A1 | PHOSPHONIUM CATIONS AND POLYMERS INCORPORATING THEM | UNIVERSITY OF DELAWARE (US) | 2017-05-25 | — | — | US | disclosed |
| WO-2012056294-A1 | AN IMPROVED PROCESS FOR THE PREPARATION OF N-PENTANOYL-N-[[2'-(1H-TETRAZOL-5-YI)[1,1'-BIPHENYL]-4-YI]METHYL]-L-VALINE | JUBILANT LIFE SCIENCES LTD. (IN) | 2012-05-03 | — | — | WO | disclosed |
| US-20120101048-A1 | COMPOUNDS FOR ENZYME INHIBITION | ONYX THERAPEUTICS, INC. (US) | 2012-04-26 | — | — | US | disclosed |
| CN-101993358-A | A process for producing 4-(4-halo-1-oxybutyl)-alpha,alpha-dimethylbenzene acetic acid or alkyl esters thereof | JUBILANT ORGANOSYS LTD | 2011-03-30 | — | — | CN | disclosed |
| EP-2289867-A2 | A process for producing 4-(4-halo-1-oxybutyl)-alpha,alpha-dimethylbenzene acetic acid or alkyl esters thereof | Jubilant Organosys Limited (IN) | 2011-03-02 | — | — | EP | disclosed |
| US-20100256128-A1 | GAMMA SECRETASE MODULATORS | SCHERING CORPORATION (US) | 2010-10-07 | — | — | US | disclosed |
| WO-2009034059-A2 | AZO QUINOLINIUM COMPOUNDS COMPRISING A DISULPHIDE/THIOL UNIT, COMPOSITIONS CONTAINING SAME, PROCESS FOR DYEING KERATIN FIBRES AND DEVICE | L'OREAL (FR) | 2009-03-19 | — | — | WO | disclosed |
| US-20070135426-A1 | LACTAM-CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY | 2007-06-14 | — | — | US | disclosed |
| US-5089485-A | ANTI-INFLAMMATORY FURANONES | ALLERGAN, INC. (US) | 1992-02-18 | — | — | US | disclosed |
| EP-0369811-A2 | Anti-inflammatory furanones | ALLERGAN, INC (US) | 1990-05-23 | — | — | EP | disclosed |