⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28483297 | 0.98 | ADH1B (0.30) | — | |
| SCHEMBL28051501 | 0.78 | — | — | |
| SCHEMBL4687615 | 0.71 | — | — | |
| SCHEMBL28913540 | 0.71 | — | — | |
| SCHEMBL7507406 | 0.68 | — | — | |
| SCHEMBL28290187 | 0.68 | ATM (0.32) | — | |
| SCHEMBL27984605 | 0.68 | — | — | |
| SCHEMBL3526133 | 0.67 | — | — | |
| SCHEMBL13637530 | 0.67 | — | — | |
| SCHEMBL980593 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109641899-A | Compounds and compositions as endosomal Toll-like receptor inhibitors | 诺华股份有限公司 | 2019-04-16 | — | — | CN | claimed |
| CN-105636945-B | Optionally substituted quinoline compounds | 卫材R&D管理有限公司 | 2017-11-17 | — | — | CN | claimed |
| CN-106794161-A | TrkA kinase inhibitors, composition and its method | 默沙东公司 | 2017-05-31 | — | — | CN | claimed |
| CN-110114349-A | Thiophene derivant as antivirotic | 埃尼奥制药公司 | 2019-08-09 | — | — | CN | disclosed |
| CN-110063951-A | Improve the Compounds and methods for of impaired endogenous fibrinolysis using histone deacetylase mortifier | 赛伦诺科学有限公司 | 2019-07-30 | — | — | CN | disclosed |
| CN-109641899-A | Compounds and compositions as endosomal Toll-like receptor inhibitors | 诺华股份有限公司 | 2019-04-16 | — | — | CN | disclosed |
| CN-109310675-A | Therapeutic inhibiting compound | 莱福斯希医药公司 | 2019-02-05 | — | — | CN | disclosed |
| CN-108699065-A | Tricyclic compounds and composition as kinase inhibitor | 诺华股份有限公司 | 2018-10-23 | — | — | CN | disclosed |
| CN-108349996-A | Tricyclic PI3K inhibitor compounds and methods of use thereof | 豪夫迈·罗氏有限公司 | 2018-07-31 | — | — | CN | disclosed |
| CN-107935988-A | Optionally substituted quinoline compounds | 卫材R&D管理有限公司 | 2018-04-20 | — | — | CN | disclosed |
| CN-107567438-A | Riluzole prodrug and application thereof | 拜尔哈文制药股份有限公司 | 2018-01-09 | — | — | CN | disclosed |
| CN-106928127-A | Substituted piperidine class amide derivatives and preparation method thereof and application pharmaceutically | 四川海思科制药有限公司 | 2017-07-07 | — | — | CN | disclosed |
| CN-103951661-B | A kind of preparation method of razaxaban | 南京斯贝源医药科技有限公司 | 2017-06-23 | — | — | CN | disclosed |