⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5072345 | 0.77 | — | — | |
| SCHEMBL515101 | 0.75 | — | — | |
| SCHEMBL3631529 | 0.74 | — | — | |
| SCHEMBL16668644 | 0.73 | MEN1 (0.30) | — | |
| SCHEMBL11703251 | 0.72 | — | — | |
| Ammonia Solution, Strong SCHEMBL28300541 | 0.72 | — | — | |
| SCHEMBL4759407 | 0.70 | — | — | |
| SCHEMBL28968023 | 0.70 | ALDH1A1 (0.36) | — | |
| Ammonia Solution, Strong SCHEMBL10884840 | 0.68 | — | — | |
| SCHEMBL10092153 | 0.68 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2958724-A1 | INTERNAL MOLD RELEASE AGENTS FOR POLYURETHANE MATERIALS | Henkel AG&Co. KGAA (DE) | 2015-12-30 | — | — | EP | disclosed |
| WO-2014130312-A1 | INTERNAL MOLD RELEASE AGENTS FOR POLYURETHANE MATERIALS | Henkel US IP LLC (US) | 2014-08-28 | — | — | WO | disclosed |
| EP-2571951-A2 | CONTROLLED CURE ALIPHATIC LAMINATING ADHESIVE USING NON-MIGRATING BLOCKING AGENTS FOR ORGANOMETALLIC CATALYSTS | Henkel Corporation (US) | 2013-03-27 | — | — | EP | disclosed |
| WO-2011146252-A2 | CONTROLLED CURE ALIPHATIC LAMINATING ADHESIVE USING NON-MIGRATING BLOCKING AGENTS FOR ORGANOMETALLIC CATALYSTS | HENKEL CORPORATION (US) | 2011-11-24 | — | — | WO | disclosed |
| EP-2245103-A1 | ADHESIVE AND ITS APPLICATION | Henkel AG & Co. KGaA (DE) | 2010-11-03 | — | — | EP | disclosed |
| WO-2009094905-A1 | ADHESIVE AND ITS APPLICATION | NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) | 2009-08-06 | — | — | WO | disclosed |