⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL177653 | 0.78 | — | — | |
| SCHEMBL28413921 | 0.75 | SMN1; SMN2 (0.42) | — | |
| SCHEMBL998786 | 0.74 | — | — | |
| SCHEMBL7649603 | 0.74 | TSHR (0.38) | — | |
| SCHEMBL23175183 | 0.73 | — | — | |
| SCHEMBL465368 | 0.72 | — | — | |
| SCHEMBL4542782 | 0.72 | ALDH1A1 (0.43) | — | |
| SCHEMBL4744554 | 0.71 | TSHR (0.38) | — | |
| SCHEMBL3227018 | 0.71 | ALDH1A1 (0.39) | — | |
| SCHEMBL11573333 | 0.71 | ALDH1A1 (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109503650-A | The preparation method of γ-(2,3- glycidoxy) propyl trimethoxy silicane | 湖北新蓝天新材料股份有限公司 | 2019-03-22 | — | — | CN | disclosed |
| CN-1209429-C | CMP composition containing silane modified abrasive particles | CABOT MICROELECTRONICS CORP (US) | 2005-07-06 | — | — | CN | disclosed |
| CN-1367809-A | Chemical Mechanical Polishing (CMP) Compositions Containing Silane-Modified Abrasive Particles | CABOT MICROELECTRONICS CORP (US) | 2002-09-04 | — | — | CN | disclosed |
| EP-0541747-B1 | CROSS LINKABLE POLYMERIC COMPOSITION | BOREALIS AS (DK) | 1999-08-25 | — | — | EP | disclosed |