⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18328111 | 1.00 | — | — | |
| SCHEMBL11779059 | 0.98 | TSHR (0.42) | — | |
| SCHEMBL17005797 | 0.98 | TSHR (0.42) | — | |
| SCHEMBL11277038 | 0.98 | TSHR (0.42) | — | |
| SCHEMBL11775497 | 0.98 | TSHR (0.42) | — | |
| SCHEMBL11778733 | 0.98 | TSHR (0.42) | — | |
| SCHEMBL11774631 | 0.98 | TSHR (0.42) | — | |
| SCHEMBL11279883 | 0.98 | TSHR (0.42) | — | |
| SCHEMBL11776122 | 0.98 | TSHR (0.42) | — | |
| SCHEMBL11276000 | 0.98 | TSHR (0.42) | — |
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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107468685-A | For treating the pharmaceutical composition and compound of hypertension and heart failure | 科贝源(北京)生物医药科技有限公司 | 2017-12-15 | — | — | CN | claimed |
| CN-107118143-B | The preparation method of the trifluoromethyl diaryliodonium of nickel catalysis | 武汉理工大学 | 2019-05-24 | — | — | CN | disclosed |
| CN-107468685-A | For treating the pharmaceutical composition and compound of hypertension and heart failure | 科贝源(北京)生物医药科技有限公司 | 2017-12-15 | — | — | CN | disclosed |
| CN-107118143-A | The preparation method of the trifluoromethyl diaryliodonium of nickel catalysis | 武汉理工大学 | 2017-09-01 | — | — | CN | disclosed |
| CN-102268041-A | Bulk electron-enriching phosphine ligand catalyst and preparation method and use thereof | — | 2011-12-07 | — | — | CN | disclosed |
| US-20110269964-A1 | N-Alkylation of Opiates | MALLINCKRODT INC. (US) | 2011-11-03 | — | — | US | disclosed |
| EP-1162211-B2 | ETHYLENE (CO)POLYMERS AND USES THEREOF | MITSUI CHEMICALS INC (JP) | 2011-08-24 | — | — | EP | disclosed |
| US-7687579-B2 | Ethylene (co) polymer and its use | MITSUI CHEMICALS, INC. (JP) | 2010-03-30 | — | — | US | disclosed |
| EP-1878757-B1 | Ethylene (co)polymer and its use | MITSUI CHEMICALS INC (JP) | 2009-08-26 | — | — | EP | disclosed |
| US-7563849-B2 | Ethylene (co) polymer and its use | MITSUI CHEMICALS, INC. (JP) | 2009-07-21 | — | — | US | disclosed |
| EP-1162211-A1 | ETHYLENE (CO)POLYMERS AND USES THEREOF | Mitsui Chemicals, Inc. (JP) | 2001-12-12 | — | — | EP | disclosed |
| EP-0422162-A4 | PROCESS FOR PREPARING SODIUM PHENYLPYRUVATE FROM CALCIUM PHENYLPYRUVATE | — | 1991-09-25 | — | — | EP | disclosed |
| EP-0422162-A1 | PROCESS FOR PREPARING SODIUM PHENYLPYRUVATE FROM CALCIUM PHENYLPYRUVATE | THE NUTRASWEET COMPANY (US) | 1991-04-17 | — | — | EP | disclosed |
| WO-1990011993-A1 | PROCESS FOR PREPARING SODIUM PHENYLPYRUVATE FROM CALCIUM PHENYLPYRUVATE | THE NUTRASWEET COMPANY (US) | 1990-10-18 | — | — | WO | disclosed |
| EP-0206515-B1 | PRODUCTION OF INJECTION MOLDED POLYPROPYLENE ARTICLES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1990-09-19 | — | — | EP | disclosed |
| US-4912255-A | Process for preparing sodium phenylpyruvate from calcium phenylpyruvate | NUTRASWEET COMPANY, THE | 1990-03-27 | — | — | US | disclosed |
| EP-0000555-B1 | PROCESS FOR THE PREPARATION OF OXIRANES SUBSTITUTED BY HALOGEN ALKYL | BAYER AG (DE) | 1982-02-10 | — | — | EP | disclosed |
| EP-0000555-A1 | Process for the preparation of oxiranes substituted by halogen alkyl | BAYER AG (DE) | 1979-02-07 | — | — | EP | disclosed |
| EP-0000554-A1 | Process for the preparation of oxiranes substituted by halogen alkyl | BAYER AG (DE) | 1979-02-07 | — | — | EP | disclosed |
| US-4036896-A | FREE RADICAL CATALYST | UNIVERSAL OIL PRODUCTS COMPANY (US) | 1977-07-19 | — | — | US | disclosed |