⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8726334 | 0.78 | — | — | |
| SCHEMBL337597 | 0.77 | — | — | |
| SCHEMBL284854 | 0.77 | — | — | |
| SCHEMBL18725844 | 0.77 | — | — | |
| SCHEMBL11074782 | 0.77 | — | — | |
| SCHEMBL11563602 | 0.77 | — | — | |
| SCHEMBL8677447 | 0.77 | — | — | |
| SCHEMBL108926 | 0.77 | — | — | |
| SCHEMBL107418 | 0.76 | LMNA (0.30) | — | |
| SCHEMBL20972451 | 0.75 | — | — |
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-0170011-B1 | SILYL-SUBSTITUTED CYCLOPENTADIENES, PROCESS FOR THEIR PREPARATION AND MIXTURES OF SYNTHETIC MATERIAL AND RUBBER CONTAINING THESE | Degussa Aktiengesellschaft (DE) | 1988-10-26 | — | — | EP | disclosed |
| US-4704428-A | ANCHORING AGENT FOR SILICATE FILER | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1987-11-03 | — | — | US | disclosed |
| US-4645850-A | CROSSLINKING | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1987-02-24 | — | — | US | disclosed |
| EP-0170011-A2 | Silyl-substituted cyclopentadienes, process for their preparation and mixtures of synthetic material and rubber containing these | Degussa Aktiengesellschaft (DE) | 1986-02-05 | — | — | EP | disclosed |