⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14260920 | 0.86 | — | — | |
| SCHEMBL7635421 | 0.83 | — | — | |
| SCHEMBL426716 | 0.79 | — | — | |
| SCHEMBL23526788 | 0.77 | — | — | |
| SCHEMBL6550333 | 0.77 | — | — | |
| SCHEMBL30488737 | 0.77 | — | — | |
| SCHEMBL107663 | 0.76 | — | — | |
| SCHEMBL14260921 | 0.76 | ADRB2 (0.31) | — | |
| SCHEMBL30488687 | 0.76 | — | — | |
| SCHEMBL23526589 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0033517-B1 | PROCESS FOR PREPARING SULFUR CONTAINING POLYSILOXANE POLYMERS, THE PRODUCTS OBTAINED THEREBY AND THE USE OF THE PRODUCTS AS CROSS-LINKING AGENTS | SWS Silicones Corporation (US) | 1985-08-21 | — | — | EP | disclosed |
| US-4289867-A | Organofunctional polysiloxane polymers and a method for preparing the same | SWS SILICONES CORPORATION (US) | 1981-09-15 | — | — | US | disclosed |
| EP-0033517-A1 | Process for preparing sulfur containing polysiloxane polymers, the products obtained thereby and the use of the products as cross-linking agents | SWS Silicones Corporation (US) | 1981-08-12 | — | — | EP | disclosed |