⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1601393 | 1.00 | — | — | |
| SCHEMBL1601391 | 1.00 | — | — | |
| SCHEMBL2831670 | 0.97 | — | — | |
| SCHEMBL13292040 | 0.97 | — | — | |
| SCHEMBL2831669 | 0.97 | — | — | |
| SCHEMBL9545869 | 0.83 | — | — | |
| SCHEMBL28381006 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL12551207 | 0.75 | RAB9A (0.33) | — | |
| SCHEMBL1447597 | 0.73 | — | — | |
| SCHEMBL5553 | 0.73 | — | — |
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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230402680-A1 | FLUIDS FOR IMMERSION COOLING OF ELECTRONIC COMPONENTS | JPMORGAN CHASE BANK, N.A., AS ADMINISTRATIVE AGENT | 2023-12-14 | — | — | US | disclosed |
| WO-2022096995-A1 | FLUIDS FOR IMMERSION COOLING OF ELECTRONIC COMPONENTS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2022-05-12 | — | — | WO | disclosed |
| US-9844230-B2 | Molecularly imprinted polymers selective for nitrosamines and methods of using the same | BRITISH AMERICAN TOBACCO (INVESTMENTS) LTD (GB) | 2017-12-19 | — | — | US | disclosed |
| US-9844230-B2 | Molecularly imprinted polymers selective for nitrosamines and methods of using the same | BRITISH AMERICAN TOBACCO (INVESTMENTS) LTD (GB) | 2017-12-19 | — | — | US | disclosed |
| US-20160346256-A1 | AMIDE COMPOUND AND MEDICINAL USE THEREOF | JAPAN TOBACCO INC. (JP) | 2016-12-01 | — | — | US | disclosed |
| US-20160137639-A1 | TRIAZOLE-ISOXAZOLE COMPOUND AND MEDICAL USE THEREOF | JAPAN TOBACCO INC. (JP) | 2016-05-19 | — | — | US | disclosed |
| EP-2094119-B1 | MOLECULARLY IMPRINTED POLYMERS SELECTIVE FOR TOBACCO SPECIFIC NITROSAMINES AND METHODS OF USING THE SAME | BRITISH AMERICAN TOBACCO CO (GB) | 2016-03-09 | — | — | EP | disclosed |
| US-9265283-B2 | Polymers selective for tobacco specific nitrosamines and methods of using the same | BRITISH AMERICAN TOBACCO (INVESTMENTS) LIMITED (GB) | 2016-02-23 | — | — | US | disclosed |
| US-9265283-B2 | Polymers selective for tobacco specific nitrosamines and methods of using the same | BRITISH AMERICAN TOBACCO (INVESTMENTS) LIMITED (GB) | 2016-02-23 | — | — | US | disclosed |
| US-9243096-B2 | Polymers selective for nitro-containing compounds and methods of using the same | BRITISH AMERICAN TOBACCO (INVESTMENTS) LIMITED (GB) | 2016-01-26 | — | — | US | disclosed |
| US-20110041859-A1 | Molecularly Imprinted Polymers Selective for Tobacco Specific Nitrosamines and Methods of Using the Same | BRITISH AMERICAN TOBACCO (INVESTMENTS) LIMITED (GB) | 2011-02-24 | — | — | US | disclosed |
| US-20110041859-A1 | Molecularly Imprinted Polymers Selective for Tobacco Specific Nitrosamines and Methods of Using the Same | BRITISH AMERICAN TOBACCO (INVESTMENTS) LIMITED (GB) | 2011-02-24 | — | — | US | disclosed |
| US-20090042973-A1 | Inhibitors of aspartyl protease | VERTEX PHARMACEUTICALS INCORPORATED | 2009-02-12 | — | — | US | disclosed |
| US-20090042973-A1 | Inhibitors of aspartyl protease | VERTEX PHARMACEUTICALS INCORPORATED | 2009-02-12 | — | — | US | disclosed |
| US-20080318943-A1 | Compounds and Uses Thereof - 848 | ASTRAZENECA AB (SE) | 2008-12-25 | — | — | US | disclosed |
| US-7442718-B2 | Inhibitors of aspartyl protease | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-10-28 | — | — | US | disclosed |
| US-7442718-B2 | Inhibitors of aspartyl protease | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2008-10-28 | — | — | US | disclosed |
| WO-2008068153-A2 | MOLECULARLY IMPRINTED POLYMERS SELECTIVE FOR TOBACCO SPECIFIC NITROSAMINES AND METHODS OF USING THE SAME | BRITISH AMERICAN TOBACCO (INVESTMENTS) LIMITED (GB) | 2008-06-12 | — | — | WO | disclosed |
| US-20070186940-A1 | Molecularly imprinted polymers selective for nitrosamines and methods of using the same | BRITISH AMERICAN TOBACCO (INVESTMENTS) LIMITED (GB) | 2007-08-16 | — | — | US | disclosed |
| US-20070186940-A1 | Molecularly imprinted polymers selective for nitrosamines and methods of using the same | BRITISH AMERICAN TOBACCO (INVESTMENTS) LIMITED (GB) | 2007-08-16 | — | — | US | disclosed |