⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5697019 | 0.77 | — | — | |
| SCHEMBL12515118 | 0.77 | — | — | |
| SCHEMBL1605756 | 0.77 | — | — | |
| SCHEMBL11641828 | 0.77 | — | — | |
| SCHEMBL17935769 | 0.71 | TSHR (0.39) | — | |
| SCHEMBL2992474 | 0.71 | — | — | |
| SCHEMBL17935613 | 0.71 | TSHR (0.39) | — | |
| Dimethylketone Cyanohydrin SCHEMBL28204579 | 0.71 | TSHR (0.56) | — | |
| SCHEMBL15209462 | 0.69 | TSHR (0.44) | — | |
| SCHEMBL20111211 | 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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3634409-B1 | OREXIN RECEPTOR ANTAGONISTS | BENEVOLENTAI BIO LTD (GB) | 2021-04-07 | — | — | EP | disclosed |
| US-20200190090-A1 | OREXIN RECEPTOR ANTAGONISTS | BENEVOLENTAI BIO LIMITED (GB) | 2020-06-18 | — | — | US | disclosed |
| EP-3634409-A1 | OREXIN RECEPTOR ANTAGONISTS | Benevolentai Bio Limited (GB) | 2020-04-15 | — | — | EP | disclosed |
| WO-2020016117-A1 | METHOD FOR PRODUCING OLIGOMERIC POLYISOCYANATES | COVESTRO DEUTSCHLAND AG (DE) | 2020-01-23 | — | — | WO | disclosed |
| WO-2020016118-A1 | METHOD FOR PRODUCING OLIGOMERIC POLYISOCYANATES WITH SUBSEQUENT FRACTIONAL LIQUID-LIQUID EXTRACTION | COVESTRO DEUTSCHLAND AG (DE) | 2020-01-23 | — | — | WO | disclosed |
| WO-2020016119-A1 | METHOD FOR OLIGOMERIZING ISOCYANATES BY MEANS OF POLYHEDRAL SILSESQUIOXANE CATALYSTS | COVESTRO DEUTSCHLAND AG (DE) | 2020-01-23 | — | — | WO | disclosed |
| WO-2020016120-A1 | METHOD FOR PRODUCING OLIGOMERIC COMPOUNDS BY FRACTIONAL EXTRACTIVE REACTION | COVESTRO DEUTSCHLAND AG (DE) | 2020-01-23 | — | — | WO | disclosed |
| WO-2018206959-A1 | OREXIN RECEPTOR ANTAGONISTS | BENEVOLENTAI BIO LIMITED (GB) | 2018-11-15 | — | — | WO | disclosed |
| WO-2018206956-A1 | OREXIN RECEPTOR ANTAGONISTS | BENEVOLENTAI BIO LIMITED (GB) | 2018-11-15 | — | — | WO | disclosed |
| EP-2174937-B1 | Synthesis process of polyol carbonate from polyols, conducted in using a solvent selective for polyols carbonates | ARKEMA FRANCE (FR) | 2015-04-15 | — | — | EP | disclosed |
| US-8877948-B2 | Synthesis process of polyol carbonate from polyols, conducted in using a solvent selective for polyols carbonates | ARKEMA FRANCE (FR) | 2014-11-04 | — | — | US | disclosed |
| US-20110245513-A1 | SYNTHESIS PROCESS OF POLYOL CARBONATE FROM POLYOLS, CONDUCTED IN USING A SOLVENT SELECTIVE FOR POLYOLS CARBONATES | ARKEMA FRANCE (FR) | 2011-10-06 | — | — | US | disclosed |
| EP-2174937-A1 | Synthesis process of polyol carbonate from polyols, conducted in using a solvent selective for polyols carbonates | ARKEMA FRANCE (FR) | 2010-04-14 | — | — | EP | disclosed |
| US-7601747-B1 | One-pot process for making di-functional di-tetrazole diols to produce tetrazole based polymers | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2009-10-13 | — | — | US | disclosed |
| US-7528257-B1 | Process for making di-functional tetrazole diols to produce tetrazole base polymers | NAVY, UNITED STATES OF AMERICA, THE, AS REPRESENTED BY THE SECRETARY OF THE | 2009-05-05 | — | — | US | disclosed |
| EP-0872475-B1 | Inhibiting formation of foulants in acrylonitrile manufacture or recovery | NALCO EXXON ENERGY CHEM LP (US) | 2003-10-22 | — | — | EP | disclosed |
| EP-0872475-A2 | Inhibiting formation of foulants in acrylonitrile manufacture or recovery | NALCO/EXXON ENERGY CHEMICALS, L.P. (US) | 1998-10-21 | — | — | EP | disclosed |