⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6266628 | 0.83 | — | — | |
| SCHEMBL20995523 | 0.82 | ROCK2 (0.31) | — | |
| SCHEMBL2921191 | 0.82 | — | — | |
| SCHEMBL3119471 | 0.80 | — | — | |
| SCHEMBL19183323 | 0.79 | — | — | |
| SCHEMBL1562146 | 0.78 | — | — | |
| SCHEMBL28716425 | 0.75 | — | — | |
| SCHEMBL22490822 | 0.75 | — | — | |
| SCHEMBL315209 | 0.74 | — | — | |
| SCHEMBL22609260 | 0.72 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4313622-A1 | RUBBER MIXTURES CONTAINING N,N?-DIALKYL-P-PHENYLENEDIAMINES | LANXESS Deutschland GmbH (DE) | 2024-02-07 | — | — | EP | disclosed |
| WO-2023247368-A1 | RUBBER BLENDS CONTAINING ETHOXYLATED ALCOHOL | LANXESS DEUTSCHLAND GMBH (DE) | 2023-12-28 | — | — | WO | disclosed |
| WO-2023247369-A1 | RUBBER BLENDS CONTAINING AT LEAST ONE FUNCTIONALIZED SYNTHETIC RUBBER AND AT LEAST ONE ETHOXYLATED ALCOHOL | LANXESS DEUTSCHLAND GMBH (DE) | 2023-12-28 | — | — | WO | disclosed |
| EP-4296078-A1 | RUBBER MIXTURES CONTAINING AT LEAST ONE FUNCTIONALIZED SYNTHETIC RUBBER AND AT LEAST ONE ETHOXYLATED ALCOHOL | LANXESS Deutschland GmbH (DE) | 2023-12-27 | — | — | EP | disclosed |
| EP-4296075-A1 | RUBBER COMPOSITIONS CONTAINING ETHOXYLATED ALCOHOL | LANXESS Deutschland GmbH (DE) | 2023-12-27 | — | — | EP | disclosed |
| EP-2163575-B1 | Rubber item comprising colloidal silica | CONTINENTAL REIFEN DEUTSCHLAND (DE) | 2011-10-19 | — | — | EP | disclosed |
| EP-2163575-A1 | Rubber item | Continental Reifen Deutschland GmbH (DE) | 2010-03-17 | — | — | EP | disclosed |
| EP-1603925-A2 | PROCESS FOR THE MANUFACTURE OF BLOCKED MERCAPTOSILANES | GENERAL ELECTRIC COMPANY (US) | 2005-12-14 | — | — | EP | disclosed |
| WO-2004078813-A2 | PROCESS FOR THE MANUFACTURE OF BLOCKED MERCAPTOSILANES | GENERAL ELECTRIC COMPANY (US) | 2004-09-16 | — | — | WO | disclosed |
| US-6777569-B1 | REACTING POLYSULFANE-CONTAINING ORGANOSILICON COMPOUND WITH ALKALI OR ALKALINE EARTH METAL OR COMPOUND, REACTING METAL SALT WITH AN ACYL HALIDE OR CARBONYL DIHALIDE | GENERAL ELECTRIC COMPANY | 2004-08-17 | — | — | US | disclosed |