⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1078641 | 0.89 | — | — | |
| SCHEMBL6389566 | 0.86 | CES2 (0.32) | — | |
| SCHEMBL30112907 | 0.82 | — | — | |
| SCHEMBL1269036 | 0.81 | — | — | |
| SCHEMBL1269410 | 0.81 | — | — | |
| SCHEMBL1268943 | 0.81 | — | — | |
| SCHEMBL1078889 | 0.77 | — | — | |
| SCHEMBL1269379 | 0.77 | — | — | |
| SCHEMBL1077053 | 0.77 | — | — | |
| SCHEMBL1267997 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8609797-B2 | Room temperature vulcanizable polymers | HONEYWELL INTERNATIONAL INC. (US) | 2013-12-17 | — | — | US | claimed |
| US-20110028639-A1 | ROOM TEMPERATURE VULCANIZABLE POLYMERS | HONEYWELL INTERNATIONAL, INC. (US) | 2011-02-03 | — | — | US | claimed |