⚠ 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 | |
|---|---|---|---|---|
| Tert-Butylamine SCHEMBL8148552 | 0.86 | ALDH1A1 (0.32) | — | |
| SCHEMBL28488688 | 0.79 | ALDH1A1 (0.41) | — | |
| SCHEMBL8330396 | 0.76 | KDM4E (0.44) | — | |
| SCHEMBL29050923 | 0.74 | ALDH1A1 (0.44) | — | |
| SCHEMBL14560578 | 0.73 | CES1 (0.38) | — | |
| SCHEMBL442427 | 0.71 | — | — | |
| SCHEMBL5394765 | 0.69 | — | — | |
| SCHEMBL14560562 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL16150019 | 0.69 | — | — | |
| SCHEMBL372540 | 0.69 | — | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111218104-B | Heat-resistant thermoplastic polyurethane elastomer composition and preparation method and application thereof | 万华化学集团股份有限公司 | 2022-04-22 | — | — | CN | disclosed |
| EP-3341375-B1 | PROCESS FOR PREPARING PARP INHIBITOR, CRYSTALLINE FORMS, AND USES THEREOF | BEIGENE LTD (KY) | 2022-04-13 | — | — | EP | disclosed |
| US-20180044580-A1 | METHODS OF EXTRACTING HYDROCARBONS FROM SUBTERRANEAN FORMATIONS | BAKER HUGHES INC (US) | 2018-02-15 | — | — | US | disclosed |
| US-9816026-B2 | Methods of extracting hydrocarbons from subterranean formations | Baker Hughes, LLC (US) | 2017-11-14 | — | — | US | disclosed |
| US-20170261874-A1 | ELECTROPHOTOGRAPHIC PHOTORECEPTOR, PROCESS CARTRIDGE, IMAGE FORMING APPARATUS, AND CONDUCTIVE SUBSTRATE THAT MAY BE INCLUDED IN ELECTROPHOTOGRAPHIC PHOTORECEPTOR | FUJI XEROX CO., LTD. (JP) | 2017-09-14 | — | — | US | disclosed |
| US-20160348488-A1 | METHODS OF EXTRACTING HYDROCARBONS FROM SUBTERRANEAN FORMATIONS | BAKER HUGHES INCORPORATED | 2016-12-01 | — | — | US | disclosed |
| US-9273080-B2 | Metal complexes | MEREK PATENT GMBH (DE) | 2016-03-01 | — | — | US | disclosed |
| WO-2016012333-A1 | PESTICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2016-01-28 | — | — | WO | disclosed |
| WO-2014150132-A1 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | MERCK SHARP & DOHME CORP. (US) | 2014-09-25 | — | — | WO | disclosed |
| US-20130082209-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2013-04-04 | — | — | US | disclosed |
| US-20100055416-A1 | COMPOSITE AND MANUFACTURING METHOD THEREOF | SAMSUNG ELECTRO-MECHANICS CO., LTD. (KR) | 2010-03-04 | — | — | US | disclosed |
| US-6887817-B2 | Olefin polymerization catalyst and process for preparing polyolefins using said catalyst | FORMOSA PLASTICS CORPORATION, U.S.A. (US) | 2005-05-03 | — | — | US | disclosed |
| US-20040039139-A1 | Olefin polymerization catalyst and process for preparing polyolefins using said catalyst | FORMOSA PLASTICS CO., U.S.A. | 2004-02-26 | — | — | US | disclosed |
| US-20030069372-A1 | Olefin polymerization catalyst and process for preparing polyolefins with said catalyst | FORMOSA PLASTICS CORPORATION, U.S.A. | 2003-04-10 | — | — | US | disclosed |
| US-4187385-A | TITANIUM COMPONENT COPULVERIZED WITH ORGANOALUMINUM COMPOUND AND ETHYLENE OR A-OLEFINS, PARTICLE SIZE | MITSUI TOATSU CHEMICAL, INC. (JP) | 1980-02-05 | — | — | US | disclosed |