⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2579414 | 0.79 | — | — | |
| SCHEMBL565613 | 0.75 | — | — | |
| SCHEMBL18586595 | 0.73 | — | — | |
| SCHEMBL8089076 | 0.73 | — | — | |
| SCHEMBL19712168 | 0.73 | — | — | |
| SCHEMBL8084206 | 0.71 | — | — | |
| SCHEMBL19712164 | 0.69 | — | — | |
| SCHEMBL25175282 | 0.69 | — | — | |
| SCHEMBL159233 | 0.67 | — | — | |
| SCHEMBL9721003 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2076521-B1 | SYNTHESIS OF SILYLSUBSTITUTED 1,2-ALKYNES | UNIV ADAM MICKIEWICZ (PL) | 2012-12-26 | — | — | EP | disclosed |
| US-20090318726-A1 | NEW SILYLSUBSTITUTED 1,2-ALKYNES AND SYNTHESIS OF SILYLSUBSTITUTED 1,2-ALKYNES | ADAM MICKIEWICZ UNIVERSITY (PL) | 2009-12-24 | — | — | US | disclosed |
| EP-2076521-A1 | NEW SILYLSUBSTITUTED 1,2-ALKYNES AND SYNTHESIS OF SILYLSUBSTITUTED 1,2-AIKYNES | Adam Mickiewicz University (PL) | 2009-07-08 | — | — | EP | disclosed |
| WO-2008020774-A1 | NEW SILYLSUBSTITUTED 1,2-ALKYNES AND SYNTHESIS OF SILYLSUBSTITUTED 1,2-AIKYNES | ADAM MICKIEWICZ UNIVERSITY (PL) | 2008-02-21 | — | — | WO | disclosed |