⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6580612 | 0.77 | MPO (0.32) | — | |
| SCHEMBL7420751 | 0.72 | GSK3B (0.33) | — | |
| SCHEMBL3641375 | 0.69 | TSHR (0.40) | — | |
| SCHEMBL4966817 | 0.64 | CA1 (0.30) | — | |
| SCHEMBL670160 | 0.62 | — | — | |
| SCHEMBL27537648 | 0.62 | — | — | |
| SCHEMBL2016425 | 0.62 | — | — | |
| SCHEMBL28455455 | 0.62 | — | — | |
| SCHEMBL7107049 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL28656210 | 0.61 | — | — |
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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106905247-B | Acetamides and application thereof | 华东理工大学 | 2019-05-17 | — | — | CN | claimed |
| CN-109071543-A | Inhibit the pyridine derivate of RAF kinases and vascular endothelial growth factor receptor, preparation method contains its medical composition and its use | 三进制药株式会社 | 2018-12-21 | — | — | CN | claimed |
| EP-3233087-A1 | GEMINAL SUBSTITUTED QUINUCLIDINE AMIDE COMPOUNDS AS AGONISTS OF ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTORS | Axovant Sciences GmbH (DE) | 2017-10-25 | — | — | EP | claimed |
| CN-106938997-A | N (4 substitution phenethyl) acetamides and application thereof | 华东理工大学 | 2017-07-11 | — | — | CN | claimed |
| CN-106905247-A | Acetamides and application thereof | 华东理工大学 | 2017-06-30 | — | — | CN | claimed |
| WO-2016100184-A1 | GEMINAL SUBSTITUTED QUINUCLIDINE AMIDE COMPOUNDS AS AGONISTS OF ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTORS | FORUM PHARMACEUTICALS, INC. (US) | 2016-06-23 | — | — | WO | claimed |
| CN-101990433-A | Compounds that enhance atoh-1 expression | BRIGHAM & WOMENS HOSPITAL | 2011-03-23 | — | — | CN | claimed |
| CN-1735441-A | Combination for treating attention deficit hyperactivity disorder | PHARMACIA & UPJOHN CO LLC (US) | 2006-02-15 | — | — | CN | claimed |
| CN-115551855-A | Small molecule inhibitors of galectin-3 | 百时美施贵宝公司 | 2022-12-30 | — | — | CN | disclosed |
| CN-110092774-B | Aromatic propionic acid derivative, preparation method and application thereof | 中国科学院上海药物研究所 | 2022-04-08 | — | — | CN | disclosed |
| CN-113727988-A | Small molecule inhibitors of galectin-3 | 百时美施贵宝公司 | 2021-11-30 | — | — | CN | disclosed |
| CN-113710665-A | Small molecule inhibitors of galectin-3 | 百时美施贵宝公司 | 2021-11-26 | — | — | CN | disclosed |
| CN-113166122-A | Small molecule inhibitors of galectin-3 | 百时美施贵宝公司 | 2021-07-23 | — | — | CN | disclosed |
| CN-109071543-B | Pyridine derivatives inhibiting RAF kinase and vascular endothelial growth factor receptor, process for their preparation, pharmaceutical compositions containing them and their use | 三进制药株式会社 | 2021-07-16 | — | — | CN | disclosed |
| EP-2603513-A1 | HETEROCYCLIC COMPOUND AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2013-06-19 | — | — | EP | disclosed |
| WO-2012020848-A1 | HETEROCYCLIC COMPOUND AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-02-16 | — | — | WO | disclosed |
| CN-101631546-A | Use of spiro-indolone compounds as therapeutic agents | XENON PHARMACEUTICALS INC | 2010-01-20 | — | — | CN | disclosed |
| CN-1735441-A | Combination for treating attention deficit hyperactivity disorder | PHARMACIA & UPJOHN CO LLC (US) | 2006-02-15 | — | — | CN | disclosed |
| EP-1131321-A2 | INDOLE DERIVATIVES AND THEIR USE AS SEROTONIN RECEPTOR LIGANDS | ELI LILLY AND COMPANY LIMITED (GB) | 2001-09-12 | — | — | EP | disclosed |
| WO-2000031074-A2 | INDOLE DERIVATIVES AND THEIR USE AS SEROTONIN RECEPTOR LIGANDS | ELI LILLY AND COMPANY LIMITED (GB) | 2000-06-02 | — | — | WO | disclosed |