⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6532281 | 0.74 | — | — | |
| SCHEMBL22036307 | 0.70 | — | — | |
| SCHEMBL11650464 | 0.70 | — | — | |
| SCHEMBL56415 | 0.67 | — | — | |
| SCHEMBL7062559 | 0.67 | — | — | |
| SCHEMBL3990235 | 0.67 | — | — | |
| SCHEMBL2294948 | 0.65 | — | — | |
| SCHEMBL343352 | 0.65 | — | — | |
| SCHEMBL1158365 | 0.64 | LMNA (0.47) | — | |
| SCHEMBL125137 | 0.63 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0060697-B1 | HETEROCYCLIC DERIVATIVES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1986-12-30 | — | — | EP | claimed |
| CN-114206823-A | Hydrogen storage materials comprising metal organic structures | 学校法人立教学院 | 2022-03-18 | — | — | CN | disclosed |
| CN-109825312-A | Liquid crystal media with vertical plane orientation | 默克专利股份有限公司 | 2019-05-31 | — | — | CN | disclosed |
| CN-105001879-B | Liquid-crystalline medium with homeotropic alignment | 默克专利股份有限公司 | 2019-04-09 | — | — | CN | disclosed |
| US-20170173572-A1 | CHIRAL LIGAND-BASED METAL-ORGANIC FRAMEWORKS FOR BROAD-SCOPE ASYMMETRIC CATALYSIS | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2017-06-22 | — | — | US | disclosed |
| US-9680113-B2 | Organic electroluminescent materials and devices | UNIVERSAL DISPLAY CORPORATION (US) | 2017-06-13 | — | — | US | disclosed |
| CN-105001879-A | Liquid-crystalline medium with homeotropic alignment | MERCK PATENT GMBH | 2015-10-28 | — | — | CN | disclosed |
| EP-2077992-B1 | INDOLE ANTAGONISTS OF P2Y1 RECEPTOR USEFUL IN THE TREATMENT OF THROMBOTIC CONDITIONS | BRISTOL MYERS SQUIBB CO (US) | 2013-08-14 | — | — | EP | disclosed |
| US-8110695-B2 | Compounds and compositions containing silicon and/or other heteroatoms and/or metals and methods of making and using them | WELKER MARK E (US) | 2012-02-07 | — | — | US | disclosed |
| US-20100056801-A1 | Compounds And Compositions Containing Silicon And/Or Other Heteroatoms And/Or Metals And Methods of Making And Using Them | WELKER MARK E | 2010-03-04 | — | — | US | disclosed |
| EP-1306369-B1 | NOVEL SULFUR COMPOUNDS AND INTERMOLECULAR COMPOUNDS CONTAINING THE SAME AS THE COMPONENT COMPOUND | NIPPON SODA CO (JP) | 2008-11-05 | — | — | EP | disclosed |
| US-6217955-B1 | Liquid crystal display device | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2001-04-17 | — | — | US | disclosed |
| CN-1189824-A | 1-amino-3-benzyluracils | BASF AG (DE) | 1998-08-05 | — | — | CN | disclosed |
| US-5013775-A | Sizing composition and sizing method | DIC-HERCULES CHEMICALS, INC. (JP) | 1991-05-07 | — | — | US | disclosed |