SCHEMBL135398

SCHEMBL135398

C#CC(OCC)OCC

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL12524820 0.86
Urea SCHEMBL29104378 0.85 ALOX15 (0.37)
SCHEMBL29188254 0.83 ALDH1A1 (0.37)
SCHEMBL6754744 0.77
SCHEMBL9091533 0.73
SCHEMBL9091076 0.73
SCHEMBL9090661 0.73
SCHEMBL6754865 0.73 ADRB2 (0.36)
SCHEMBL7299256 0.71
SCHEMBL6752666 0.71 ALDH1A1 (0.31)

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 1100 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240150390-A1 NOVEL METHOD FOR PRODUCING ANTIBODY-IMMUNOSTIMULATOR CONJUGATE DAIICHI SANKYO COMPANY, LIMITED (JP) 2024-05-09 US claimed
EP-4286393-A1 NOVEL METHOD FOR PRODUCING ANTIBODY-IMMUNOSTIMULATOR CONJUGATE Daiichi Sankyo Company, Limited (JP) 2023-12-06 EP claimed
US-11814462-B2 Functionalized cyclic polymers and methods of preparing same UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2023-11-14 US claimed
CN-116003422-A Synthesis method of 6-bromofuro [3,2-b ] pyridine-2-formaldehyde 康化(上海)新药研发有限公司 2023-04-25 CN claimed
WO-2022163846-A1 NOVEL METHOD FOR PRODUCING ANTIBODY-IMMUNOSTIMULATOR CONJUGATE 第一三共株式会社 2022-08-04 WO claimed
US-20220056167-A1 Functionalized Cyclic Polymers and Methods of Preparing Same NATIONAL SCIENCE FOUNDATION 2022-02-24 US claimed
WO-2020223672-A1 FUNCTIONALIZED CYCLIC POLYMERS AND METHODS OF PREPARING SAME UNIVERSITY OF FLORIDA RESEARCHFOUNDATION, INC. (US) 2020-11-05 WO claimed
CN-109293727-A 1- methyl purine -4- methylenandrosta-triazole derivatives, its synthetic method and application 郑州大学 2019-02-01 CN claimed
CN-109232703-A Containing 16- (1 '-aromatic radical -1 ', 2 ', 3 '-triazoles) methylene-androstane -17- ketone derivatives 郑州大学 2019-01-18 CN claimed
US-20130295019-A1 LIGANDS AND METHODS FOR LABELING BIOMOLECULES IN VIVO ALBERT EINSTEIN COLLEGE OF MEDICINE OF YESHIVA UNI (US) 2013-11-07 US claimed
US-20030082830-A1 Synthesis of combinatorial libraries of compounds reminiscent of natural products NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-05-01 US claimed
EP-0875540-B1 Single phase system based on coreactive latex resins ATOFINA (FR) 2002-11-13 EP claimed
US-6448443-B1 GENERATED FROM DIVERSIFIABLE SCAFFOLDS SYNTHESIZED FROM THE PYRIDINE-BASED TEMPLATE ISONICOTINAMIDE; ALSO PROVIDES A NOVEL ORTHO-NITROBENZYL PHOTOLINKER; SYNTHESIZED FROM A SHIKIMIC ACID BASED EPOXYOL TEMPLATE PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2002-09-10 US claimed
WO-2000006525-A9 SYNTHESIS OF COMBINATORIAL LIBRARIES OF COMPOUNDS REMINISCENT OF NATURAL PRODUCTS HARVARD COLLEGE (US) 2000-04-20 WO claimed
WO-2000006525-A2 SYNTHESIS OF COMBINATORIAL LIBRARIES OF COMPOUNDS REMINISCENT OF NATURAL PRODUCTS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2000-02-10 WO claimed
EP-0875540-A1 Single phase system based on coreactive latex resins ELF ATOCHEM S.A. (FR) 1998-11-04 EP claimed
EP-0875543-A1 Single phase systeme based on coreactive copolymers ELF ATOCHEM S.A. (FR) 1998-11-04 EP claimed
EP-0875542-A1 Single phase system based on coreactive polymers ELF ATOCHEM S.A. (FR) 1998-11-04 EP claimed
EP-0582788-B1 7-(Substituted)-9- (substituted glycyl)-amido)-6-demethyl-6-deoxytetracyclines AMERICAN CYANAMID CO (US) 1998-07-29 EP claimed
EP-0287079-B1 2-Phenoxypyrimidine derivatives and herbicidal compositions KUMIAI CHEMICAL INDUSTRY CO (JP) 1994-10-12 EP claimed