SCHEMBL506732

SCHEMBL506732

[Na+].[O-]CO

nearest known ligand 0.00

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

⚠ 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
SCHEMBL29395916 0.86
Potassium Ion SCHEMBL233230 0.86
SCHEMBL27605893 0.86
SCHEMBL8983376 0.80 TSHR (0.30)
SCHEMBL615867 0.76
Alcohol SCHEMBL129479 0.72
Tetramethylammonium Ion SCHEMBL2400585 0.72
Alcohol SCHEMBL28237139 0.68 TSHR (0.55)
SCHEMBL31739985 0.68
SCHEMBL44894 0.66

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 1723 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118179291-B Enhanced polyethylene nanofiltration membrane and preparation method thereof 上海工程技术大学 2024-10-01 CN claimed
CN-118530153-A Preparation method of 1-Boc-3-azetidinone 上海津力药业股份有限公司 2024-08-23 CN claimed
CN-118271318-A Preparation method of valnemulin 杭州新曦科技有限公司 2024-07-02 CN claimed
CN-118108456-B Preparation method of high-strength concrete 天津天桩建材科技有限公司 2024-06-21 CN claimed
CN-118221520-A Chemical recovery system and method for waste PET (polyethylene terephthalate) products 中国石油化工股份有限公司 2024-06-21 CN claimed
CN-118191161-A Exosome metabolite combination, kit and method for depression detection 重庆医科大学附属永川医院(重庆市第二人民医院) 2024-06-14 CN claimed
CN-118146406-A Polyvinyl alcohol used as emulsion polymerization dispersion stabilizer and preparation method thereof 中国石油化工股份有限公司 2024-06-07 CN claimed
CN-118146428-A Polyvinyl alcohol for polymerizing main dispersing agent and preparation method thereof 中国石油化工股份有限公司 2024-06-07 CN claimed
CN-118108456-A Preparation method of high-strength concrete 天津天桩建材科技有限公司 2024-05-31 CN claimed
CN-118085158-A Polyvinyl alcohol and preparation method thereof 中国石油化工股份有限公司 2024-05-28 CN claimed
CN-102551095-A Treatment method for increasing polyunsaturated fatty acid in cut beef of Qinchuan cattle UNIV SHAANXI NORMAL 2012-07-11 CN claimed
CN-102276614-A Alpha-tetra-(4-carboxyphenoxy) phthalocyanine, and preparation method thereof and application thereof to molecular selfassembling field 2011-12-14 CN claimed
CN-102250285-A Semi-covalent molecularly imprinted polymer used for selectivity separating phenols, preparation method thereof, and application thereof DALIAN CHEMICAL PHYSICS INST 2011-11-23 CN claimed
CN-102241681-A Preparation method of carboxyl-substituted metal phthalocyanine UNIV SHANDONG WEIHAI 2011-11-16 CN claimed
WO-2009002055-A1 MANUFACTURING METHOD OF DIESEL USING WASTE CORN OIL VODUSTM CO.,LTD (KR) 2008-12-31 WO claimed
CN-101328419-A Method for producing diesel fuel with waste edible oil BINGYU YU (CN) 2008-12-24 CN claimed
CN-1289516-C Synthesis of fructosamine perfume compound and fumet function for tobaco QIU YE (CN) 2006-12-13 CN claimed
CN-1680416-A Synthesis of fructosamine perfume compound and fumet function for tobaco QIU YE (CN) 2005-10-12 CN claimed
US-4950750-A Glycolipid containing N-glycolylneuraminic acid and method of producing the same MECT CORPORATION (JP) 1990-08-21 US claimed
EP-0114011-B1 IODINE-LABELLED RADIOACTIVE ESTRATRIENE DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION, THEIR USE IN RADIOIMMUNO ASSAYS AND IN THE PREPARATION OF ANTIGENS, AND ANTIGENS SO OBTAINED ROUSSEL-UCLAF (FR) 1986-11-12 EP claimed