⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1466357 | 0.81 | — | — | |
| SCHEMBL5192444 | 0.81 | — | — | |
| SCHEMBL5193000 | 0.73 | — | — | |
| SCHEMBL7003398 | 0.73 | — | — | |
| SCHEMBL2717494 | 0.71 | GRM5 (0.39) | — | |
| SCHEMBL767264 | 0.71 | CYP1A2 (0.35) | — | |
| SCHEMBL3353825 | 0.69 | GRM5 (0.42) | — | |
| SCHEMBL3935598 | 0.66 | — | — | |
| SCHEMBL18992849 | 0.63 | GRM5 (0.30) | — | |
| SCHEMBL524541 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1427735-B1 | ALKYNYLSILANES AS FUELS AND ROCKET PROPELLANTS | WILEY ORGANICS INC (US) | 2007-08-08 | — | — | EP | claimed |
| US-20050076560-A1 | Alkynylsilanes as fuels and rocket propellants | WILEY ORGANICS, INC. | 2005-04-14 | — | — | US | claimed |
| EP-1427735-A2 | ALKYNYLSILANES AS FUELS AND ROCKET PROPELLANTS | Wiley Organics, Inc. (US) | 2004-06-16 | — | — | EP | claimed |
| WO-2003104244-A2 | ALKYNYLSILANES AS FUELS AND ROCKET PROPELLANTS | WILEY ORGANICS, INC. (US) | 2003-12-18 | — | — | WO | claimed |
| EP-1183256-B1 | PURINE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | AVENTIS PHARMA SA (FR) | 2007-08-22 | — | — | EP | disclosed |
| EP-1427735-B1 | ALKYNYLSILANES AS FUELS AND ROCKET PROPELLANTS | WILEY ORGANICS INC (US) | 2007-08-08 | — | — | EP | disclosed |
| US-20050076560-A1 | Alkynylsilanes as fuels and rocket propellants | WILEY ORGANICS, INC. | 2005-04-14 | — | — | US | disclosed |
| EP-1427735-A2 | ALKYNYLSILANES AS FUELS AND ROCKET PROPELLANTS | Wiley Organics, Inc. (US) | 2004-06-16 | — | — | EP | disclosed |
| WO-2003104244-A2 | ALKYNYLSILANES AS FUELS AND ROCKET PROPELLANTS | WILEY ORGANICS, INC. (US) | 2003-12-18 | — | — | WO | disclosed |