⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8916177 | 1.00 | — | — | |
| SCHEMBL10794757 | 0.97 | — | — | |
| SCHEMBL19310485 | 0.91 | — | — | |
| SCHEMBL7203109 | 0.84 | — | — | |
| SCHEMBL28875927 | 0.78 | — | — | |
| SCHEMBL584038 | 0.71 | — | — | |
| SCHEMBL11868696 | 0.71 | ALDH1A1 (0.36) | — | |
| SCHEMBL10369058 | 0.71 | — | — | |
| SCHEMBL2391382 | 0.71 | — | — | |
| SCHEMBL28818185 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-11952327-B2 | Methods and compositions for terpenoid synthesis | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) | 2024-04-09 | — | — | US | disclosed |
| US-20240025843-A1 | METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. | 2024-01-25 | — | — | US | disclosed |
| CN-110520413-A | Big ring broad-spectrum antibiotic | RQX PHARMACEUTICALS INC | 2019-11-29 | — | — | CN | disclosed |
| US-20190270700-A1 | METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS | UNIV FLORIDA (US) | 2019-09-05 | — | — | US | disclosed |
| CN-106458859-B | Novel EP4 agonists as therapeutic compounds | 阿勒根公司 | 2019-08-30 | — | — | CN | disclosed |
| CN-109071446-A | The organic reaction carried out in aqueous solution in the presence of hydroxy alkyl (alkyl) cellulose or alkylcellulose | 艾伯维德国有限责任两合公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-105189508-B | Naphthenic base nitrile Pyrazolopyridine ketone as JANUS kinase inhibitor | 默沙东公司 | 2018-11-23 | — | — | CN | disclosed |
| CN-108541257-A | Water-based composition based on polyalkenamer | 巴斯夫欧洲公司 | 2018-09-14 | — | — | CN | disclosed |
| WO-2018053322-A1 | METHODS AND COMPOSITIONS FOR TERPENOID SYNTHESIS | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) | 2018-03-22 | — | — | WO | disclosed |
| CN-103987707-B | The base heterocyclic radical benzamide compound of pyrazoles 4 and application method | 霍夫曼-拉罗奇有限公司 | 2017-11-07 | — | — | CN | disclosed |
| CN-106573930-A | 6-alkynyl-pyridine derivatives | 勃林格殷格翰国际有限公司 | 2017-04-19 | — | — | CN | disclosed |
| CN-106458859-A | Novel EP 4 agonists as therapeutic compounds | 阿勒根公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-1989111-B | Method for the production of 3-phenyl(thio)uracils and dithiouracils | BASF AG | 2012-12-05 | — | — | CN | disclosed |