⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL233520 | 0.91 | — | — | |
| Propane SCHEMBL1536015 | 0.86 | — | — | |
| Trimethylammonium SCHEMBL20742045 | 0.86 | LMNA (0.33) | — | |
| SCHEMBL284366 | 0.85 | ALOX15 (0.32) | — | |
| SCHEMBL7056633 | 0.83 | ALDH1A1 (0.36) | — | |
| Butane SCHEMBL1536097 | 0.83 | TSHR (0.36) | — | |
| Cyclohexane SCHEMBL11119971 | 0.82 | LMNA (0.35) | — | |
| SCHEMBL4618776 | 0.80 | — | — | |
| Hexane SCHEMBL1536101 | 0.79 | ZDHHC20 (0.45) | — | |
| Piperazine SCHEMBL284766 | 0.76 | GABRP (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1879558-B1 | PHARMACEUTICAL COMPOSITION COMPRISING GAS-FILLED MICROCAPSULES FOR ULTRASOUND MEDIATED DELIVERY | BRACCO RESEARCH SA (CH) | 2010-06-09 | — | — | EP | disclosed |
| US-20090041833-A1 | Composition comprising gas-filled microcapsules for ultrasound mediated delivery | BRACCO RESEARCH S.A. (CH) | 2009-02-12 | — | — | US | disclosed |
| EP-1879558-A1 | PHARMACEUTICAL COMPOSITION COMPRISING GAS-FILLED MICROCAPSULES FOR ULTRASOUND MEDIATED DELIVERY | BRACCO RESEARCH S.A. (CH) | 2008-01-23 | — | — | EP | disclosed |
| WO-2006111490-A1 | PHARMACEUTICAL COMPOSITION COMPRISING GAS-FILLED MICROCAPSULES FOR ULTRASOUND MEDIATED DELIVERY | BRACCO RESEARCH SA (CH) | 2006-10-26 | — | — | WO | disclosed |
| EP-1714642-A1 | Pharmaceutical composition comprising gas-filled microcapsules for ultrasound mediated delivery | BRACCO RESEARCH S.A. (CH) | 2006-10-25 | — | — | EP | disclosed |