⚠ 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 SCHEMBL29753194 | 0.98 | SLC6A2 (0.36) | — | |
| SCHEMBL873427 | 0.79 | — | — | |
| SCHEMBL21069936 | 0.79 | — | — | |
| SCHEMBL21070848 | 0.79 | — | — | |
| SCHEMBL6689960 | 0.79 | — | — | |
| SCHEMBL1777157 | 0.79 | — | — | |
| SCHEMBL8742282 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL3945988 | 0.78 | SLC6A4 (0.36) | — | |
| SCHEMBL2483427 | 0.76 | SLC6A2 (0.36) | — | |
| SCHEMBL1746181 | 0.75 | SLC6A2 (0.42) | — |
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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107973787-B | Coumarin derivative DMAC (Dimethylacetamide) and preparation method and application thereof | 山西大学 | 2021-02-02 | — | — | CN | claimed |
| CN-107973787-A | A kind of coumarin derivative DMAC and its preparation method and application | 山西大学 | 2018-05-01 | — | — | CN | claimed |
| CN-105153214-B | A kind of silicon substrate rhodamine nitric oxide fluorescent probe and its preparation method and application | 中国人民解放军第二军医大学 | 2018-02-02 | — | — | CN | claimed |
| EP-1226126-B1 | PYRIMIDINE DERIVATIVES | ASTRAZENECA AB (SE) | 2005-01-05 | — | — | EP | claimed |
| CN-107973787-B | Coumarin derivative DMAC (Dimethylacetamide) and preparation method and application thereof | 山西大学 | 2021-02-02 | — | — | CN | disclosed |
| CN-104761544-B | The selective depressant of the important mutant of clinic of EGFR tyrosine kinase | 北京轩义医药科技有限公司 | 2019-03-15 | — | — | CN | disclosed |
| CN-107973787-A | A kind of coumarin derivative DMAC and its preparation method and application | 山西大学 | 2018-05-01 | — | — | CN | disclosed |
| CN-105153214-B | A kind of silicon substrate rhodamine nitric oxide fluorescent probe and its preparation method and application | 中国人民解放军第二军医大学 | 2018-02-02 | — | — | CN | disclosed |
| WO-2016210239-A1 | METHODS OF IDENTIFYING NOVEL ANTIBIOTICS USING IN SITU CLICK CHEMISTRY | TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2016-12-29 | — | — | WO | disclosed |
| CN-101743242-A | Heterocyclic compounds useful as RAF kinase inhibitors | BIOGEN IDEC INC | 2010-06-16 | — | — | CN | disclosed |
| EP-1979311-A2 | PHENOXY ACETIC ACIDS AS PPAR DELTA ACTIVATORS | TRANSTECH PHARMA (US) | 2008-10-15 | — | — | EP | disclosed |
| EP-1904504-A2 | INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING | Methylgene, Inc. (CA) | 2008-04-02 | — | — | EP | disclosed |
| WO-2006010264-A1 | INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING | METHYLGENE, INC. (CA) | 2006-02-02 | — | — | WO | disclosed |
| EP-1585749-A1 | DIAZEPINOINDOLE DERIVATIVES AS KINASE INHIBITORS | PFIZER INC. (US) | 2005-10-19 | — | — | EP | disclosed |
| WO-2004063198-A1 | DIAZEPINOINDOLE DERIVATIVES AS KINASE INHIBITORS | PFIZER INC. (US) | 2004-07-29 | — | — | WO | disclosed |
| EP-1075467-A1 | PYRAZOLE DERIVATIVES AS P-38 MAP KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2001-02-14 | — | — | EP | disclosed |
| WO-1999057101-A1 | PYRAZOLE DERIVATIVES AS P-38 MAP KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 1999-11-11 | — | — | WO | disclosed |
| US-5017724-A | Antihypoxic, CNS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1991-05-21 | — | — | US | disclosed |
| EP-0267024-B1 | HYDROFLUORENE DERIVATIVES | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1991-05-02 | — | — | EP | disclosed |
| EP-0267024-A2 | Hydrofluorene derivatives | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1988-05-11 | — | — | EP | disclosed |