⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7526813 | 0.77 | — | — | |
| SCHEMBL3843678 | 0.73 | — | — | |
| SCHEMBL28422086 | 0.69 | — | — | |
| SCHEMBL3941195 | 0.69 | — | — | |
| SCHEMBL5832570 | 0.69 | — | — | |
| SCHEMBL3744698 | 0.65 | — | — | |
| SCHEMBL10739623 | 0.65 | — | — | |
| SCHEMBL15270549 | 0.65 | ALDH1A1 (0.35) | — | |
| SCHEMBL9849296 | 0.63 | — | — | |
| SCHEMBL1789455 | 0.62 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0669949-B1 | TERTIARY AMINE DERIVATIVES AS COMPONENTS OF POLYMER FORMING SYSTEMS | COGNIS CORP (US) | 2002-03-13 | — | — | EP | disclosed |
| US-5444127-A | Urea, thiourea, guanidine derivatives, curing agents for epoxy resins, odorless, low temperature | HENKEL CORPORATION (US) | 1995-08-22 | — | — | US | disclosed |
| EP-0014745-B1 | CURING AGENT FOR POLYEPOXIDES, CURABLE EPOXY RESIN COMPOSITIONS, HARDENED PRODUCTS THEREFROM AND PROCESS FOR CURING A POLYEPOXIDE | DIAMOND SHAMROCK CORPORATION (US) | 1983-05-25 | — | — | EP | disclosed |
| EP-0075827-A2 | Polyepoxide curing by polymercaptans plus catalytic co-curing agents | DIAMOND SHAMROCK CHEMICALS COMPANY (US) | 1983-04-06 | — | — | EP | disclosed |
| US-4177173-A | INFUSIBLE FILMS, CASTINGS OR ADHESIVES | DIAMOND SHAMROCK CORPORATION (US) | 1979-12-04 | — | — | US | disclosed |