⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13370283 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL28188527 | 0.96 | — | — | |
| SCHEMBL7942 | 0.96 | — | — | |
| Benzene SCHEMBL4297098 | 0.96 | ALDH1A1 (0.43) | — | |
| SCHEMBL1778307 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL5929655 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL4462903 | 0.92 | ALDH1A1 (0.40) | — | |
| Ammonia Solution, Strong SCHEMBL22686091 | 0.92 | — | — | |
| SCHEMBL16054548 | 0.92 | — | — | |
| Fluoride SCHEMBL704319 | 0.92 | ALDH1A1 (0.40) | — |
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-110072935-A | inorganic foaming agent preparation | 株式会社东进世美肯 | 2019-07-30 | — | — | CN | disclosed |
| CN-106380579-B | The organic porous polymer and its preparation method and application of a kind of azo-based benzene | 武汉工程大学 | 2019-02-01 | — | — | CN | disclosed |
| CN-105980487-B | Coated metallic pigments, Its Preparation Method And Use, smears and product | 埃卡特有限公司 | 2018-07-13 | — | — | CN | disclosed |
| CN-106380579-A | Azobenzene-based organic porous polymers, and preparation method and application thereof | 武汉工程大学 | 2017-02-08 | — | — | CN | disclosed |
| CN-102438970-B | Wittig reaction and the light of catalysis prolong reaction | BOARD OF REGENTS THE UNIVERSITY OF TEXAS SYSTEM (US) | 2015-10-14 | — | — | CN | disclosed |
| US-20120305072-A1 | METHOD FOR MANUFACTURING SEMICONDUCTOR DEVICE AND BACK-CONTACT SOLAR CELL | TORAY INDUSTRIES, INC. (JP) | 2012-12-06 | — | — | US | disclosed |
| EP-2515345-A1 | METHOD FOR MANUFACTURING SEMICONDUCTOR DEVICE AND BACK JUNCTION SOLAR CELL | Toray Industries, Inc. (JP) | 2012-10-24 | — | — | EP | disclosed |
| CN-102438970-A | Catalytic wittig and mitsunobu reactions | UNIV TEXAS | 2012-05-02 | — | — | CN | disclosed |
| CN-101687188-A | Preparation of supported silyl-capped silica silica-bound anion activators and associated catalysts | EXXONMOBIL CHEM PATENTS INC | 2010-03-31 | — | — | CN | disclosed |