⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6746739 | 0.85 | CYP1A2 (0.43) | — | |
| SCHEMBL4351390 | 0.83 | ALDH1A1 (0.32) | — | |
| SCHEMBL13933203 | 0.83 | ALDH1A1 (0.32) | — | |
| SCHEMBL2350568 | 0.77 | ALDH1A1 (0.44) | — | |
| SCHEMBL29777525 | 0.77 | ALDH1A1 (0.44) | — | |
| SCHEMBL4093161 | 0.72 | HPGD (0.35) | — | |
| SCHEMBL1929080 | 0.71 | TRPM4 (0.38) | — | |
| SCHEMBL4096457 | 0.70 | GABRP (0.32) | — | |
| SCHEMBL6748527 | 0.70 | CYP1A2 (0.42) | — | |
| SCHEMBL6747101 | 0.69 | CYP1A2 (0.41) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080312463-A1 | Organic Silane Compound, Method of Producing the Same, and Organic Thin Film Using the Same | SHARP KABUSHIKI KAISHA (JP) | 2008-12-18 | — | — | US | disclosed |
| US-20070195576-A1 | Organic compound having functional groups different in elimination reactivity at both terminals, organic thin film, organic device and method of producing the same | SHARP KABUSHIKI KAISHA (JP) | 2007-08-23 | — | — | US | disclosed |
| CN-1961435-A | Organic compound having at both ends different functional groups differing in reactivity in elimination reaction, organic thin films, organic device, and processes for producing these | SHARP KK (JP) | 2007-05-09 | — | — | CN | disclosed |