⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16577595 | 0.77 | — | — | |
| SCHEMBL9138833 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL31492348 | 0.72 | — | — | |
| SCHEMBL11149056 | 0.72 | — | — | |
| SCHEMBL301942 | 0.70 | — | — | |
| SCHEMBL79453 | 0.70 | — | — | |
| SCHEMBL28659221 | 0.69 | ALDH1A1 (0.36) | — | |
| SCHEMBL8830278 | 0.69 | — | — | |
| SCHEMBL11654982 | 0.67 | ALDH1A1 (0.42) | — | |
| SCHEMBL1459052 | 0.67 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-63132906-A | — | — | None | — | — | JP | disclosed |
| US-8097745-B2 | Method of producing organosilicon compound | JSR CORPORATION (JP) | 2012-01-17 | — | — | US | disclosed |
| US-20110082309-A1 | METHOD OF PRODUCING ORGANOSILICON COMPOUND | JSR CORPORATION (JP) | 2011-04-07 | — | — | US | disclosed |
| EP-1520846-B1 | Method for producing polymerized hydrocarbon | JFE CHEMICAL CORP (JP) | 2008-03-05 | — | — | EP | disclosed |
| JP-S63132906-A | POLYMERIZATION OF OLEFIN | MITSUI TOATSU CHEM INC | 1988-06-04 | — | — | JP | disclosed |