SCHEMBL2168923

SCHEMBL2168923

C=C(CC)C(=O)[O-].[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
Potassium Ion SCHEMBL4020497 0.97
SCHEMBL18315385 0.94 FFAR3 (0.35)
Lithium Ion SCHEMBL18315387 0.94 FFAR3 (0.35)
SCHEMBL11155457 0.94 FFAR3 (0.35)
Lithium Ion SCHEMBL6335954 0.94
SCHEMBL7910827 0.94 FFAR3 (0.35)
SCHEMBL18204912 0.94 FFAR3 (0.35)
Zinc Ion SCHEMBL9065097 0.94 FFAR3 (0.35)
SCHEMBL10776087 0.94 FFAR3 (0.35)
SCHEMBL9053203 0.94 FFAR3 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024125385-A1 METHOD FOR PREPARING MODIFIED POLYACRYLIC ACID BINDER AND USE 湖北亿纬动力有限公司 2024-06-20 WO claimed
CN-118126232-A Solid foam discharging agent and preparation method thereof 中国石油化工股份有限公司 2024-06-04 CN claimed
CN-117736668-A Adhesive, negative plate comprising adhesive and battery 珠海冠宇动力电池有限公司 2024-03-22 CN claimed
CN-113045702-B Boric acid derivative modified binder and lithium ion battery containing same 珠海冠宇电池股份有限公司 2023-06-16 CN claimed
US-20200385629-A1 NANOSIZED SCALE INHIBITORS FOR INCREASING OILFIELD SCALE INHIBITION TREATMENT LIFETIME THE TEXAS A&M UNIVERSITY SYSTEM (US) 2020-12-10 US claimed
US-5171808-A Used in floculation of dispersions of suspended solids and in paper making AMERICAN CYANAMID COMPANY (US) 1992-12-15 US claimed
US-4066560-A POLYSILOXANES GENERAL ELECTRIC COMPANY (US) 1978-01-03 US claimed
CN-121021759-A Environment-friendly anti-collapse agent and application thereof 天府永兴实验室 2025-11-28 CN disclosed
WO-2025125923-A1 COMPOSITIONS OF ASCORBIC ACID SALTS SHISEIDO COMPANY, LTD. (JP) 2025-06-19 WO disclosed
US-20250186325-A1 COMPOSITIONS OF ASCORBIC ACID SALTS SHISEIDO COMPANY, LTD. (JP) 2025-06-12 US disclosed
US-20250188201-A1 CATALYST FOR PHOTOCATALYTIC POLYMERIZATION REACTION, AND APPLICATION THEREOF BEIJING INSTITUTE OF FASHION TECHNOLOGY (CN) 2025-06-12 US disclosed
WO-2025108737-A1 COSMETIC COMPOSITIONS COMPRISING A POLYMER AND A SURFACTANT CLARIANT INTERNATIONAL LTD (CH) 2025-05-30 WO disclosed
EP-3554644-B1 WATER-SOLUBLE AND/OR WATER-SWELLABLE HYBRID POLYMER CLARIANT INT LTD (CH) 2025-03-19 EP disclosed
US-20130184482-A1 Process For Preparing An Acryloyloxysilane DOW CORNING CORPORATION (US) 2013-07-18 US disclosed
WO-2013081820-A2 ESTER-FUNCTIONAL SILANES AND THE PREPARATION AND USE THEREOF;AND USE OF IMINIUM COMPOUNDS AS PHASE TRANSFER CATALYSTS DOW CORNING CORPORATION (US) 2013-06-06 WO disclosed
US-20120269890-A1 PROCESS FOR OBTAINING A ROSUVASTATIN CALCIUM COMPOSITION AND OBTAINED PRODUCT PSICOFARMA, S.A. DE C.V. (MX) 2012-10-25 US disclosed
WO-2012050761-A2 PROCESS FOR PREPARING AN ACRYLOYLOXYSILANE DOW CORNING CORPORATION (US) 2012-04-19 WO disclosed
EP-2347758-A1 PROCESS FOR OBTAINING A COMPOSITION OF ROSUVASTATIN CALCIUM AND PRODUCT OBTAINED Psicofarma S.a. De C.v. (MX) 2011-07-27 EP disclosed
US-4341563-A HYDROPHOBIC, HIGHER FATTY ACID OR SALT, WAX, SURFACTANT SANKYO COMPANY LIMITED (JP) 1982-07-27 US disclosed
US-4066560-A POLYSILOXANES GENERAL ELECTRIC COMPANY (US) 1978-01-03 US disclosed