⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3990744 | 0.82 | — | — | |
| SCHEMBL674056 | 0.82 | — | — | |
| SCHEMBL19239957 | 0.79 | — | — | |
| SCHEMBL8672603 | 0.77 | — | — | |
| SCHEMBL9303257 | 0.71 | — | — | |
| SCHEMBL12929625 | 0.71 | — | — | |
| SCHEMBL6456180 | 0.69 | — | — | |
| SCHEMBL41538 | 0.69 | — | — | |
| SCHEMBL14559258 | 0.69 | — | — | |
| SCHEMBL8327439 | 0.69 | — | — |
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-5347028-A | Highly functionalized polycyclosiloxanes and their polymerization into thermally reversible living rubbers | TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 1994-09-13 | — | — | US | disclosed |
| US-5298589-A | Polycyclosiloxanes and polydimethylsiloxane with catalysts | TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 1994-03-29 | — | — | US | disclosed |
| WO-1994002536-A1 | POLYCYCLOSILOXANES AND THERMALLY REVERSIBLE LIVING SILICONE RUBBERS | TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 1994-02-03 | — | — | WO | disclosed |