SCHEMBL472819

SCHEMBL472819

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

nearest known ligand 0.41

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.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA2 known ✓ P00918 2/20 0.41
CA1 known ✓ P00915 2/20 0.39
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
NFKB1 P19838 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GPR84 Q9NQS5 1/20 0.35
CES2 O00748 2/20 0.34
CES1 P23141 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL1283040 1.00 CA2 (0.41) CA2CA1CYP3A4TSHRNFKB1
SCHEMBL7207850 1.00 CA2 (0.41) CA2CA1CYP3A4TSHRNFKB1
SCHEMBL7098262 1.00 CA2 (0.41) CA2CA1CYP3A4TSHRNFKB1
SCHEMBL626430 1.00 CA2 (0.41) CA2CA1CYP3A4TSHRNFKB1
SCHEMBL7096164 1.00 CA2 (0.41) CA2CA1CYP3A4TSHRNFKB1
SCHEMBL223461 1.00 CA2 (0.41) CA2CA1CYP3A4TSHRNFKB1
SCHEMBL7095267 1.00 CA2 (0.41) CA2CA1CYP3A4TSHRNFKB1
SCHEMBL7098222 1.00 CA2 (0.41) CA2CA1CYP3A4TSHRNFKB1
SCHEMBL9651092 1.00 CA2 (0.41) CA2CA1CYP3A4TSHRNFKB1
SCHEMBL7100030 1.00 CA2 (0.41) CA2CA1CYP3A4TSHRNFKB1

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 1125 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118649658-A Heavy metal ion adsorbent and preparation method and application thereof 陕西广润源环保科技有限公司 2024-09-17 CN claimed
US-20190051946-A1 LEAD-ACID BATTERY SEPARATORS, ELECTRODES, BATTERIES, AND METHODS OF MANUFACTURE AND USE THEREOF ENCINA PRIVATE CREDIT SPV 2, LLC, AS COLLATERAL AGENT 2019-02-14 US claimed
US-10116007-B2 Lead-acid battery separators, electrodes, batteries, and methods of manufacture and use thereof DARAMIC, LLC (US) 2018-10-30 US claimed
EP-3140875-A1 IMPROVED LEAD-ACID BATTERY SEPARATORS, ELECTRODES, BATTERIES, AND METHODS OF MANUFACTURE AND USE THEREOF Daramic, Llc (US) 2017-03-15 EP claimed
US-20160075971-A1 COPPER CLEANING AND PROTECTION FORMULATIONS ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2016-03-17 US claimed
EP-2989231-A1 COPPER CLEANING AND PROTECTION FORMULATIONS Advanced Technology Materials, Inc. (US) 2016-03-02 EP claimed
US-20150318529-A1 LEAD-ACID BATTERY SEPARATORS, ELECTRODES, BATTERIES, AND METHODS OF MANUFACTURE AND USE THEREOF ENCINA PRIVATE CREDIT SPV 2, LLC, AS COLLATERAL AGENT 2015-11-05 US claimed
WO-2014176193-A1 COPPER CLEANING AND PROTECTION FORMULATIONS ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2014-10-30 WO claimed
US-20130280123-A1 METHOD FOR PREVENTING THE COLLAPSE OF HIGH ASPECT RATIO STRUCTURES DURING DRYING ADVANCED TECHNOLOGY MATERIALS, INC. (US) 2013-10-24 US claimed
US-20110274844-A1 AGENT FOR THE TREATMENT OF TOP-COAT PAINT FILMS TO IMPART STAIN RESISTANCE AND A METHOD FOR THE TREATMENT OF TOP-COAT PAINT FILMS TO IMPART STAIN-RESISTANCE BASF COATINGS JAPAN LTD. (JP) 2011-11-10 US claimed
US-5639715-A Aqueous based drilling fluid additive and composition M-I DRILLING FLUIDS LLC 1997-06-17 US claimed
EP-0673984-A1 Aqueous based drilling fluid additive and composition M-I DRILLING FLUIDS COMPANY (US) 1995-09-27 EP claimed
EP-0192533-B1 ALCALISILICATE COMPOSITIONS AND THEIR USE RHONE-POULENC CHIMIE (FR) 1989-11-08 EP claimed
US-4799549-A PLUGGING SOIL FOR OIL RECOVERY RHONE-POULENC SPECIALITES CHIMIQUE (FR) 1989-01-24 US claimed
US-4670538-A AGITATION AT REDUCED PRESSURE AND TEMPERATURE WITH ADDITION OF SURFACTANT CHLOE CHIMIE (FR) 1987-06-02 US claimed
US-4348954-A A POLYOXYALKYLENE ALKYLPHENYL ETHER NONIONIC SURFACTANT, AND A SODIUM DIALKYL SULFOSUCCINATE ANIONIC SURFACTANT FUJI PHOTO FILM CO., LTD. (JP) 1982-09-14 US claimed
US-4268613-A Agent for protecting the surface of lithographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 1981-05-19 US claimed
US-4052331-A SURFACE ACTIVE COMPOSITION RHONE-POULENC S.A. (FR) 1977-10-04 US claimed
US-4026991-A Process for stabilizing lime mud AMERICAN CYANAMID COMPANY (US) 1977-05-31 US claimed
US-3975294-A POLYETHYLENE GLYCOL, MONOETHER; SODIUM DIALKYLSULFOSUCCINATE; OLEIC, LINOLEIC, LINOLENIC OR RICINOLEIC ACID; TRIETHANOLAMINE OR N-HYDROXYETHYLMORPHOLINE RHONE-POULENC S.A. (FR) 1976-08-17 US claimed