⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL211559 | 0.72 | — | — | |
| SCHEMBL9538391 | 0.70 | — | — | |
| SCHEMBL11034282 | 0.70 | — | — | |
| SCHEMBL11622512 | 0.68 | — | — | |
| SCHEMBL11590195 | 0.68 | — | — | |
| SCHEMBL3725336 | 0.68 | — | — | |
| SCHEMBL445991 | 0.68 | — | — | |
| SCHEMBL30549393 | 0.68 | — | — | |
| Boric Acid SCHEMBL8843765 | 0.65 | — | — | |
| SCHEMBL7170806 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9593228-B2 | Mixtures composed of functionalized diene rubbers with trimethylolpropane and fatty acid, a process for production thereof and use thereof | ARLANXEO DEUTSCHLAND GMBH (DE) | 2017-03-14 | — | — | US | disclosed |
| US-20120270974-A1 | MIXTURES COMPOSED OF FUNCTIONALIZED DIENE RUBBERS WITH TRIMETHYLOLPROPANE AND FATTY ACID, A PROCESS FOR PRODUCTION THEREOF AND USE THEREOF | RHEIN CHEMIE RHEINAU GMBH (DE) | 2012-10-25 | — | — | US | disclosed |
| WO-2010136345-A1 | MIXTURES COMPOSED OF FUNCTIONALIZED DIENE RUBBERS WITH TRIMETHYLOLPROPANE AND FATTY ACID, A PROCESS FOR PRODUCTION THEREOF AND USE THEREOF | LANXESS DEUTSCHLAND GMBH (DE) | 2010-12-02 | — | — | WO | disclosed |