⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20057463 | 0.95 | ALDH1A1 (0.36) | — | |
| SCHEMBL284757 | 0.85 | NUDT1 (0.34) | — | |
| SCHEMBL284223 | 0.82 | TSHR (0.37) | — | |
| SCHEMBL283947 | 0.82 | TSHR (0.37) | — | |
| Ether SCHEMBL5030187 | 0.82 | ALDH1A1 (0.43) | — | |
| SCHEMBL1276341 | 0.82 | TSHR (0.40) | — | |
| SCHEMBL21896357 | 0.82 | ALDH1A1 (0.31) | — | |
| SCHEMBL14002886 | 0.82 | ALDH1A1 (0.31) | — | |
| SCHEMBL28051745 | 0.81 | NUDT1 (0.31) | — | |
| SCHEMBL11073204 | 0.80 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114761177-B | Grid abrasive and preparation method thereof | 3M创新有限公司 | 2025-01-07 | — | — | CN | disclosed |
| EP-2334677-B1 | TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS | ARRAY BIOPHARMA INC (US) | 2013-10-09 | — | — | EP | disclosed |
| US-20110144085-A1 | TRIAZOLOPYRIDINE COMPOUNDS AS PIM KINASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2011-06-16 | — | — | US | disclosed |
| US-7399812-B2 | Silicon ether compounds and a method for the preparation thereof | CHINA PETROLEUM & CHEMICAL CORPORATION (CN) | 2008-07-15 | — | — | US | disclosed |
| US-20060183873-A1 | Silicon ether compounds and a method for the preparation thereof | BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY, CHINA PETROLEUM & CHEMICAL CORPORATION (CN) | 2006-08-17 | — | — | US | disclosed |
| US-7071359-B1 | Neuropathy improvers containing nitrogenous compounds as the active ingredient | TEIJIN LIMITED (JP) | 2006-07-04 | — | — | US | disclosed |
| EP-1201235-B1 | NEUROPATHY IMPROVERS CONTAINING NITROGENOUS COMPOUNDS AS THE ACTIVE INGREDIENT | TEIJIN LTD (JP) | 2005-10-12 | — | — | EP | disclosed |
| EP-1201235-A1 | NEUROPATHY IMPROVERS CONTAINING NITROGENOUS COMPOUNDS AS THE ACTIVE INGREDIENT | TEIJIN LIMITED (JP) | 2002-05-02 | — | — | EP | disclosed |
| EP-0133881-A1 | Aliphatic monoethers of 2,2-dimethylpropane-1,3-diol with C3 to C20 alkoxy groups, with the exception of 3-isopropoxy-2,2-dimethylpropane-1-ol and 3-tert.butoxy-2,2-dimethylpropane-1-ol, process for their production and their use as plasticizer alcohols | HÜLS AKTIENGESELLSCHAFT (DE) | 1985-03-13 | — | — | EP | disclosed |