⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14983323 | 0.97 | SHBG (0.32) | — | |
| SCHEMBL14983324 | 0.78 | CYP1A2 (0.33) | — | |
| SCHEMBL21562036 | 0.75 | — | — | |
| SCHEMBL14983322 | 0.75 | CYP1A2 (0.40) | — | |
| SCHEMBL5953380 | 0.73 | ALDH1A1 (0.31) | — | |
| SCHEMBL3904564 | 0.69 | — | — | |
| SCHEMBL3953140 | 0.67 | — | — | |
| SCHEMBL27790913 | 0.64 | NAAA (0.35) | — | |
| SCHEMBL9709468 | 0.64 | NAAA (0.35) | — | |
| SCHEMBL3899023 | 0.61 | SHBG (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116063604-B | Bimodal polyethylene resin for pipe material product, preparation method thereof and pipe material product | 中国石油化工股份有限公司 | 2024-11-19 | — | — | CN | disclosed |
| CN-116063604-A | Bimodal polyethylene resin for pipe material product, preparation method thereof and pipe material product | 中国石油化工股份有限公司 | 2023-05-05 | — | — | CN | disclosed |
| US-11291981-B2 | Boron-based electron donors for Ziegler-Natta catalyst systems | BRASKEM AMERICA, INC. (US) | 2022-04-05 | — | — | US | disclosed |
| EP-3668643-A1 | BORON-BASED ELECTRON DONORS FOR ZIEGLER-NATTA CATALYST SYSTEMS | Braskem America, Inc. (US) | 2020-06-24 | — | — | EP | disclosed |
| WO-2019036376-A1 | BORON-BASED ELECTRON DONORS FOR ZIEGLER-NATTA CATALYST SYSTEMS | BRASKEM AMERICA, INC. (US) | 2019-02-21 | — | — | WO | disclosed |
| US-20190046965-A1 | BORON-BASED ELECTRON DONORS FOR ZIEGLER-NATTA CATALYST SYSTEMS | BRASKEM AMERICA, INC. | 2019-02-14 | — | — | US | disclosed |
| CN-102875709-B | Preparation method of catalyst component for ethylene polymerization reaction and catalyst thereof | CHINA PETROLEUM & CHEMICAL | 2014-08-06 | — | — | CN | disclosed |
| CN-102875709-A | Preparation method of catalyst component for ethylene polymerization reaction and catalyst thereof | CHINA PETROLEUM & CHEMICAL | 2013-01-16 | — | — | CN | disclosed |
| CN-102344507-A | Catalyst component for vinyl polymerization and catalyst thereof | CHINA PETROLEUM & CHEMICAL | 2012-02-08 | — | — | CN | disclosed |
| CN-102344506-A | Catalyst component for vinyl polymerization and catalyst comprising the same | CHINA PETROLEUM & CHEMICAL | 2012-02-08 | — | — | CN | disclosed |