⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12851683 | 0.81 | ALDH1A1 (0.37) | — | |
| SCHEMBL637425 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL27731585 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL203335 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL198113 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL13038579 | 0.77 | ALDH1A1 (0.34) | — | |
| SCHEMBL3795919 | 0.77 | — | — | |
| Cyclopropane SCHEMBL3461994 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL662055 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL1225396 | 0.75 | ALDH1A1 (0.36) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111356652-A | Interlayer crosslinking type lamellar inorganic compound and method for producing same | 东亚合成株式会社 | 2020-06-30 | — | — | CN | disclosed |
| US-7834120-B2 | Monofunctional monomer having cage oligosiloxane structure and method of making | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2010-11-16 | — | — | US | disclosed |
| US-20100222477-A1 | FILLER FOR SUBSTRATE AND COMPOSITION FOR USE AS MATERIAL FOR INORGANIC/ORGANIC COMPOSITE SUBSTRATE FORMATION | NISSHINBO INDUSTRIES, INC. (JP) | 2010-09-02 | — | — | US | disclosed |
| US-20100160512-A1 | FLAME RETARDANT AND INORGANIC/ORGANIC COMPOSITE FLAME-RETARDANT COMPOSITION | NISSHINBO INDUSTRIES, INC. (JP) | 2010-06-24 | — | — | US | disclosed |
| EP-1645560-B1 | Monofunctional monomer having cage oligosiloxane structure and method of making | SHINETSU CHEMICAL CO (JP) | 2008-05-28 | — | — | EP | disclosed |
| EP-1900769-A1 | FLAME RETARDANT AND INORGANIC/ORGANIC COMPOSITE FLAME-RETARDANT COMPOSITION | Nisshinbo Industries, Inc. (JP) | 2008-03-19 | — | — | EP | disclosed |
| EP-1894967-A1 | FILLER FOR SUBSTRATE AND COMPOSITION FOR USE AS MATERIAL FOR INORGANIC/ORGANIC COMPOSITE SUBSTRATE FORMATION | Nisshinbo Industries, Inc. (JP) | 2008-03-05 | — | — | EP | disclosed |
| EP-1645560-A1 | Monofunctional monomer having cage oligosiloxane structure and method of making | Shin-Etsu Chemical Co., Ltd. (JP) | 2006-04-12 | — | — | EP | disclosed |
| US-20060074213-A1 | Monofunctional monomer having cage oligosiloxane structure and method of making | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2006-04-06 | — | — | US | disclosed |