SCHEMBL587040

SCHEMBL587040

O=S(=O)([O-])CCO.O=S(=O)([O-])CCO.[Ca+2]

nearest known ligand 0.43

Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.43
TP53 P04637 2/20 0.39
ALDH1A1 P00352 2/20 0.39
TSHR P16473 2/20 0.39
GMNN O75496 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
THPO P40225 1/20 0.39
HBB P68871 1/20 0.39
PMP22 Q01453 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
BBOX1 O75936 3/20 0.36
CA2 P00918 2/20 0.36
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ENPEP Q07075 2/20 0.32
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30

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
SCHEMBL17092605 0.93 KDM4E (0.43) KDM4EMAPTALOX15TP53ALDH1A1
Silver SCHEMBL1177402 0.93
SCHEMBL1404436 0.93 KDM4E (0.43) KDM4EMAPTALOX15TP53ALDH1A1
Potassium Ion SCHEMBL1304649 0.93
SCHEMBL17092588 0.93 KDM4E (0.43) KDM4EMAPTALOX15TP53ALDH1A1
SCHEMBL25252386 0.93
SCHEMBL2293214 0.93 KDM4E (0.43) KDM4EMAPTALOX15TP53ALDH1A1
Zinc Ion SCHEMBL491189 0.93 KDM4E (0.43) KDM4EMAPTALOX15TP53ALDH1A1
SCHEMBL1138504 0.93 KDM4E (0.43) KDM4EMAPTALOX15TP53ALDH1A1
Lithium Ion SCHEMBL1457942 0.93

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118580806-A Adhesive, and preparation method and application thereof 江苏正力新能电池技术股份有限公司 2024-09-03 CN claimed
CN-113816879-B Method for preparing calcium taurate and taurine through photocatalysis 万华化学集团股份有限公司 2023-03-03 CN claimed
CN-113816879-A Method for preparing calcium taurate and taurine through photocatalysis 万华化学集团股份有限公司 2021-12-21 CN claimed
US-20180161365-A1 Phosphate-Binding Magnesium Salts And Uses Thereof CURRAX PHARMACEUTICALS LLC 2018-06-14 US claimed
US-9889157-B2 Phosphate-binding magnesium salts and uses thereof CYPRESS PHARMACEUTICALS, INC. (US) 2018-02-13 US claimed
US-20170202875-A1 Phosphate-Binding Magnesium Salts And Uses Thereof WILMINGTON SAVINGS FUND SOCIETY, FSB 2017-07-20 US claimed
US-9610267-B2 Phosphate-binding magnesium salts and uses thereof CYPRESS PHARMACEUTICALS, INC. (US) 2017-04-04 US claimed
US-20160256420-A1 Phosphate-Binding Magnesium Salts And Uses Thereof WILMINGTON SAVINGS FUND SOCIETY, FSB 2016-09-08 US claimed
US-9339481-B2 Phosphate-binding magnesium salts and uses thereof CYPRESS PHARMACEUTICALS, INC. (US) 2016-05-17 US claimed
US-8349489-B2 Cathode active material, cathode therewith and nonaqueous electrolyte secondary battery SONY CORPORATION (JP) 2013-01-08 US claimed
EP-2416786-A1 PHOSPHATE-BINDING MAGNESIUM SALTS AND USES THEREOF Cypress Pharmaceutical, Inc. (US) 2012-02-15 EP claimed
WO-2010117370-A1 PHOSPHATE-BINDING MAGNESIUM SALTS AND USES THEREOF CYPRESS PHARMACEUTICALS, INC. (US) 2010-10-14 WO claimed
US-20090269399-A1 PHOSPHATE-BINDING MAGNESIUM SALTS AND USES THEREOF CYPRESS PHARMACEUTICAL, INC. (US) 2009-10-29 US claimed
US-20090202905-A1 CATHODE ACTIVE MATERIAL, CATHODE THEREWITH AND NONAQUEOUS ELECTROLYTE SECONDARY BATTERY SONY CORPORATION (JP) 2009-08-13 US claimed
CN-119505192-A Polyester resin, polyester resin composition and molded product thereof 东丽先端材料研究开发(中国)有限公司 2025-02-25 CN disclosed
CN-118580806-A Adhesive, and preparation method and application thereof 江苏正力新能电池技术股份有限公司 2024-09-03 CN disclosed
CN-113816879-B Method for preparing calcium taurate and taurine through photocatalysis 万华化学集团股份有限公司 2023-03-03 CN disclosed
WO-2009043716-A1 MILD ACYL ISETHIONATE TOILET BAR COMPOSITION UNILEVER PLC (GB) 2009-04-09 WO disclosed
US-20080058237-A1 Mild acyl isethionate toilet bar composition UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO 2008-03-06 US disclosed
US-6069262-A NON-CATALYZED ESTERIFICATION WITHIN HEATED REACTION VESSEL CONTAINING REACTION MIXTURE HAVING MOLAR EXCESS OF FATTY ACID; PERSONAL CARE CLEANSERS FINETEX, INC. (US) 2000-05-30 US disclosed