⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2066596 | 0.90 | ADH1A (0.42) | — | |
| SCHEMBL20160972 | 0.88 | ADH1A (0.48) | — | |
| SCHEMBL516222 | 0.87 | ADH1A (0.46) | — | |
| SCHEMBL5703370 | 0.84 | ADH1A (0.50) | — | |
| SCHEMBL23038 | 0.84 | ADH1A (0.50) | — | |
| SCHEMBL5703310 | 0.84 | ADH1A (0.50) | — | |
| SCHEMBL19710776 | 0.84 | PIK3CD (0.43) | — | |
| SCHEMBL736433 | 0.84 | — | — | |
| Bromide SCHEMBL11846706 | 0.82 | ADH1A (0.48) | — | |
| Hydrochloric Acid SCHEMBL2140609 | 0.82 | ADH1A (0.48) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023083373-A1 | COMPOUND USED AS SRC INHIBITOR | 微境生物医药科技(上海)有限公司 | 2023-05-19 | — | — | WO | disclosed |
| EP-2076558-B1 | COMPOSITION COMPRISING NEOPENTASILANE AND METHOD OF PREPARING SAME | DOW CORNING (US) | 2018-04-18 | — | — | EP | disclosed |
| US-9181253-B2 | Adenosine receptor agonists, partial agonists, and antagonists | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2015-11-10 | — | — | US | disclosed |
| US-20120252823-A1 | ADENOSINE RECEPTOR AGONISTS, PARTIAL AGONISTS, AND ANTAGONISTS | SERVICES (US) | 2012-10-04 | — | — | US | disclosed |
| US-8147789-B2 | Composition comprising neopentasilane and method of preparing same | DOW CORNING CORPORATION (US) | 2012-04-03 | — | — | US | disclosed |
| US-20100176338-A1 | Composition Comprising Neopentasilane And Method Of Preparing Same | NATA SEMICONDUCTOR MATERIALS CO., LTD. (CN) | 2010-07-15 | — | — | US | disclosed |
| EP-2076558-A1 | COMPOSITION COMPRISING NEOPENTASILANE AND METHOD OF PREPARING SAME | Dow Corning Corporation (US) | 2009-07-08 | — | — | EP | disclosed |
| WO-2008051328-A1 | COMPOSITION COMPRISING NEOPENTASILANE AND METHOD OF PREPARING SAME | DOW CORNING CORPORATION (US) | 2008-05-02 | — | — | WO | disclosed |
| CN-101119747-A | Tissue factor production inhibitor | SANKYO CO (JP) | 2008-02-06 | — | — | CN | disclosed |
| CN-101094827-A | Benzene compound having two or more substituents | SANKYO CO (JP) | 2007-12-26 | — | — | CN | disclosed |