SCHEMBL566642

SCHEMBL566642

CN(C)C(=O)[S-].[Na+]

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
SCHEMBL11336639 0.92 CA12 (0.44)
Potassium Ion SCHEMBL11806597 0.92
SCHEMBL3479862 0.92 CA9 (0.44)
SCHEMBL11435410 0.92 CA12 (0.44)
SCHEMBL9478834 0.92 CA12 (0.44)
SCHEMBL5901387 0.92 CA12 (0.44)
SCHEMBL10611370 0.92 CA12 (0.44)
Zinc Ion SCHEMBL1526234 0.92 ALDH1A1 (0.50)
SCHEMBL22405593 0.92 CA12 (0.44)
Water SCHEMBL4870775 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113173592-B Method for coproducing titanium gypsum by purifying titanium dioxide waste acid by sulfuric acid method step by step 郑州大学 2023-05-26 CN claimed
CN-113171881-B Method for recycling metal ions in sulfuric acid process titanium dioxide waste acid 郑州大学 2023-02-17 CN claimed
CN-113171881-A Method for recycling metal ions in sulfuric acid process titanium dioxide waste acid 郑州大学 2021-07-27 CN claimed
CN-113173592-A Method for purifying sulfuric acid process titanium dioxide waste acid and coproducing titanium gypsum step by step 郑州大学 2021-07-27 CN claimed
CN-112358882-A Cadmium-polluted soil remediation agent and preparation method thereof 湖南迈清环保科技股份有限公司 2021-02-12 CN claimed
EP-1317413-B1 SUBSTITUTED BIPHENYL DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SERVIER LAB (FR) 2005-08-24 EP claimed
US-20040014969-A1 Substituted biphenyl derivatives, method for preparing same and pharmaceutical compositions containing same LES LABORATOIRES SERVIER (FR) 2004-01-22 US claimed
EP-1038863-B1 Substituted dimeric compounds, process for their preparation and pharmaceutical compositions thereof SERVIER LAB (FR) 2003-06-04 EP claimed
EP-1057826-B1 Substituted dimeric carboxamide derivatives, method for preparing them, and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-04-16 EP claimed
US-5756771-A 5(6)-methyl substituted fluorescein derivatives ABBOTT LABORATORIES (US) 1998-05-26 US claimed
US-5091440-A Acrylate- or methacrylate-functional organopolysiloxanes WACKER SILICONES CORPORATION (US) 1992-02-25 US claimed
JP-58077805-A None JP disclosed
CN-118910406-A Method for enhancing bioleaching of chalcopyrite 中国科学院过程工程研究所 2024-11-08 CN disclosed
CN-114790023-B Microencapsulated transition metal ion scavenger and preparation method thereof 宁德时代新能源科技股份有限公司 2024-02-23 CN disclosed
US-11773237-B2 Resin composition, molded article and heat-expandable microspheres MATSUMOTO YUSHI-SEIYAKU CO., LTD. (JP) 2023-10-03 US disclosed
US-4808714-A SULFUR CURE ACCELERATORS WITH IMPROVED SCORCH SAFETY UNIROYAL CHEMICAL COMPANY, INC. (US) 1989-02-28 US disclosed
EP-0279414-A2 Rubber composition and the use thereof for the production of an oil seal or a rubber hose JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1988-08-24 EP disclosed
EP-0183493-A2 Modified ethylenic random copolymer MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1986-06-04 EP disclosed
JP-S5877805-A AGENT FOR CONTROLLING LIVING THING ATTACHED TO MATERIAL IN SEA KATAYAMA CHEM WORKS CO LTD 1983-05-11 JP disclosed
US-4101670-A THIOLCARBAMATES KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1978-07-18 US disclosed