SCHEMBL2365675

SCHEMBL2365675

O=C([O-])c1cccc(S(=O)(=O)O)c1.O=C([O-])c1cccc(S(=O)(=O)O)c1.[Na+].[Na+]

nearest known ligand 0.50

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 20)

geneUniProtsupporting neighboursconfidence
CA2 known ✓ P00918 3/20 0.48
CA4 known ✓ P22748 1/20 0.48
CA1 known ✓ P00915 2/20 0.42
TSHR P16473 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HSD17B10 Q99714 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.45
LCK P06239 1/20 0.44
FYN P06241 1/20 0.44
LMNA P02545 3/20 0.44
HTT P42858 1/20 0.44
MAPT P10636 1/20 0.42
IL1RN P18510 1/20 0.42
AKR1C3 P42330 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL1356070 1.00 TSHR (0.50) TSHRALDH1A1HSD17B10TDP1CA2
Potassium Ion SCHEMBL20584478 0.96 TSHR (0.50) TSHRALDH1A1HSD17B10TDP1CA2
Potassium Ion SCHEMBL9291258 0.96 TSHR (0.50) TSHRALDH1A1HSD17B10TDP1CA2
Benzoic Acid SCHEMBL25282020 0.89 CA2 (0.61) TSHRALDH1A1HSD17B10TDP1CA2
SCHEMBL981406 0.85 CA2 (0.48) TSHRTDP1CA2CA4SMN1; SMN2
SCHEMBL30785961 0.85 CA2 (0.48) TSHRTDP1CA2CA4SMN1; SMN2
Isophthalic Acid SCHEMBL28794421 0.84 TSHR (0.52) TSHRALDH1A1CA2CA4SMN1; SMN2
SCHEMBL21726589 0.82 TSHR (0.55) TSHRALDH1A1HSD17B10TDP1CA2
SCHEMBL3495441 0.82 TSHR (0.61) TSHRALDH1A1HSD17B10TDP1CA2
Potassium Ion SCHEMBL31530533 0.81 CA2 (0.43) TSHRALDH1A1TDP1CA2CA4

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109137007-B Environmentally friendly nickel electroplating compositions and methods 罗门哈斯电子材料有限责任公司 2020-07-07 CN disclosed
EP-3431634-A1 ENVIRONMENTALLY FRIENDLY NICKEL ELECTROPLATING COMPOSITIONS AND METHODS Rohm and Haas Electronic Materials LLC (US) 2019-01-23 EP disclosed
US-20180363157-A1 ENVIRONMENTALLY FRIENDLY NICKEL ELECTROPLATING COMPOSITIONS AND METHODS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2018-12-20 US disclosed
US-20150174170-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT AND ALLEVIATION OF BONE AND CARTILAGE DISEASES OR INJURIES AND HAIR LOSS PAK JAE WOO (KR) 2015-06-25 US disclosed
US-20150174171-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT AND ALLEVIATION OF BONE AND CARTILAGE DISEASES OR INJURIES AND HAIR LOSS PAK JAE WOO (KR) 2015-06-25 US disclosed
US-20140186320-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT, PREVENTION, AND ALLEVIATION OF BONE AND CARTILAGE DISEASES OR INJURIES AND HAIR LOSS PAK JAE WOO (KR) 2014-07-03 US disclosed
US-8658012-B2 Biosensor for electrochemical measurement of 1,5-anhydroglucitol, and measuring method and measuring kit using the same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2014-02-25 US disclosed
US-20120171179-A1 APPARATUS, SYSTEM, AND METHOD FOR COMPOSITIONS AND METHODS FOR TREATING, PREVENTING, OR ALLEVIATING BONE OR CARTILAGE DISEASES PAK JAEWOO (KR) 2012-07-05 US disclosed
US-20120171182-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT, PREVENTION, AND ALLEVIATION OF BONE AND CARTILAGE DISEASES OR INJURIES AND HAIR LOSS PAK JAE WOO (KR) 2012-07-05 US disclosed
US-20120171169-A1 COMPOSITIONS AND METHODS FOR TREATING, PREVENTING, OR ALLEVIATING BONE OR CARTILAGE DISEASES PAK JAEWOO (KR) 2012-07-05 US disclosed
US-20110259762-A1 BIOSENSOR FOR ELECTROCHEMICAL MEASUREMENT OF 1,5-ANHYDROGLUCITOL, AND MEASURING METHOD AND MEASURING KIT USING THE SAME NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-10-27 US disclosed
EP-2365326-A1 BIOSENSOR FOR ELECTROCHEMICAL MEASUREMENT OF 1,5-ANHYDROGLUCITOL, AND MEASURING METHOD AND MEASURING KIT USING THE SAME Nippon Kayaku Kabushiki Kaisha (JP) 2011-09-14 EP disclosed