⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6545392 | 0.86 | — | — | |
| SCHEMBL4416748 | 0.80 | — | — | |
| SCHEMBL9775440 | 0.78 | VCP (0.32) | — | |
| SCHEMBL85510 | 0.78 | VCP (0.32) | — | |
| SCHEMBL8979429 | 0.76 | VCP (0.31) | — | |
| Hydrogen Sulfide SCHEMBL15656308 | 0.76 | VCP (0.31) | — | |
| SCHEMBL24248413 | 0.75 | — | — | |
| SCHEMBL11603857 | 0.75 | — | — | |
| SCHEMBL7604250 | 0.75 | — | — | |
| SCHEMBL6879181 | 0.72 | VCP (0.31) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6984747-B2 | Method for preparing styryl-functionalized silanes | FRAUNHOFER-GESELLSCHAFT ZUR FORDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) | 2006-01-10 | — | — | US | disclosed |
| US-20030139621-A1 | Method for preparing styryl-functionalized silanes | FRAUNHOFER-GESELLSCHAFT ZUR FORDERUNG DER ANGEWANDTEN FORSCHUNG E.V. | 2003-07-24 | — | — | US | disclosed |