⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28139703 | 0.80 | — | — | |
| SCHEMBL51715 | 0.78 | SMN1; SMN2 (0.31) | — | |
| SCHEMBL7664176 | 0.78 | CA1 (0.36) | — | |
| SCHEMBL28162811 | 0.77 | CYP2D6 (0.36) | — | |
| SCHEMBL27766367 | 0.75 | SYK (0.32) | — | |
| SCHEMBL4765501 | 0.72 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL28131323 | 0.71 | — | — | |
| SCHEMBL21961904 | 0.70 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL1953048 | 0.68 | — | — | |
| SCHEMBL1773266 | 0.68 | HTR2C (0.31) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8802669-B2 | Dihydropyrimidine compounds and preparation methods, pharmaceutical compositions and uses thereof | INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES, P.L.A. CHINA (CN) | 2014-08-12 | — | — | US | disclosed |
| EP-2447253-B1 | DIHYDROPYRIMIDINE COMPOUNDS, PREPARATION METHODS, PHARMACEUTICAL COMPOSITIONS THEREOF AND THEIR USE AS ANTIVIRAL AGENTS | INST PHARM & TOXICOLOGY AMMS (CN) | 2014-06-18 | — | — | EP | disclosed |
| US-20120149695-A1 | DIHYDROPYRIMIDINE COMPOUNDS AND PREPARATION METHODS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. (CN) | 2012-06-14 | — | — | US | disclosed |
| EP-2447253-A1 | DIHYDROPYRIMIDINE COMPOUNDS AND PREPARATION METHODS, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF | Institute of Pharmacology and Toxicology Academy of Military Medical Sciences P.L.A. China (CN) | 2012-05-02 | — | — | EP | disclosed |