SCHEMBL4845244

SCHEMBL4845244

Sc1ccc(CBr)cc1

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
SCHEMBL131361 0.83 ALDH1A1 (0.67)
SCHEMBL15775771 0.75 IDO1 (0.52)
SCHEMBL7561165 0.75
SCHEMBL13659138 0.75
SCHEMBL13659091 0.75 TRPA1 (0.50)
SCHEMBL5885289 0.73 ALDH1A1 (0.56)
SCHEMBL679626 0.73 TSHR (0.56)
SCHEMBL9609757 0.73 TSHR (0.56)
SCHEMBL2220712 0.73 TRPA1 (0.56)
SCHEMBL63938 0.73 ALDH1A1 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115403877-A Insulating polyvinyl chloride cable composite material 扬州实嘉电缆材料有限公司 2022-11-29 CN claimed
CN-112410326-A In vitro screening method of aptamer, aptamer and kit for detecting target molecule 清华大学 2021-02-26 CN claimed
US-20230264164-A1 HOMOPOLYMER ENCODED NUCLEIC ACID MEMORY TRILINK BIOTECHNOLOGIES, LLC 2023-08-24 US disclosed
CN-112410326-B In vitro screening method of nucleic acid aptamer, nucleic acid aptamer and kit for detecting target molecule 清华大学 2023-05-12 CN disclosed
US-11612873-B2 Homopolymer encoded nucleic acid memory Molecular Assemblies, Inc. (US) 2023-03-28 US disclosed
CN-115403877-A Insulating polyvinyl chloride cable composite material 扬州实嘉电缆材料有限公司 2022-11-29 CN disclosed
CN-112410326-A In vitro screening method of aptamer, aptamer and kit for detecting target molecule 清华大学 2021-02-26 CN disclosed
WO-2020219853-A1 HOMOPOLYMER ENCODED NUCLEIC ACID MEMORY Molecular Assemblies, Inc. (US) 2020-10-29 WO disclosed
US-20190344239-A1 HOMOPOLYMER ENCODED NUCLEIC ACID MEMORY Molecular Assemblies, Inc. 2019-11-14 US disclosed
US-20180066007-A1 Macrocyclic Compounds And Methods Of Making And Using The Same BioVersys AG (CH) 2018-03-08 US disclosed
US-9556382-B2 Polymerisable mixtures and the use thereof in liquid crystal displays MERCK PATENT GMBH (DE) 2017-01-31 US disclosed
EP-2340292-B1 LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 2013-05-29 EP disclosed
US-20130114010-A1 POLYMERISABLE MIXTURES AND THE USE THEREOF IN LIQUID CRYSTAL DISPLAYS MERCK PATENT GMBH (DE) 2013-05-09 US disclosed
US-7998969-B2 enzyme inhibitors such as 4-[2-(1-Benzyl-piperidin-4-ylamino)-pyrimidin-4-yloxy]-3,5-dimethyl-benzonitrile, used in combination with other viricides, for preventing and treatment of viral infections such as HIV, AIDS and AIDS related diseases ROCHE PALO ALTO LLC (US) 2011-08-16 US disclosed
US-20100310456-A1 IMAGING OF MYELIN BASIC PROTEIN GENERAL ELECTRIC COMPANY (US) 2010-12-09 US disclosed
US-7463400-B1 Electrochromic display device FUJI XEROX CO., LTD. (JP) 2008-12-09 US disclosed
US-20080146595-A1 Non-nucleoside reverse transcriptase inhibitors ROCHE PALO ALTO LLC 2008-06-19 US disclosed
EP-1713799-A2 COMPOUNDS AND COMPOSITIONS AS LXR MODULATORS IRM, LLC (BM) 2006-10-25 EP disclosed
WO-2005077124-A2 COMPOUNDS AND COMPOSITIONS AS LXR MODULATORS IRM LLC (BM) 2005-08-25 WO disclosed
US-6284365-B1 FOR CONTROLLING PHYSICAL PROPERTIES OF SURFACE AND INTERFACE OF SOLID ARTICLE SUCH AS WETTABILITY, ADHESIVE PROPERTY, SURFACE ENERGY, DISPERSABILITY, CHEMICAL RESISTANCE FUJI XEROX CO., LTD. (JP) 2001-09-04 US disclosed