SCHEMBL8927665

SCHEMBL8927665

CCCCCCCCc1cc2ccccc2c(S(=O)(=O)[O-])c1CCCCCCCC.[Na+]

nearest known ligand 0.44

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
MAPT P10636 3/20 0.44
TLR8 Q9NR97 4/20 0.40
FUT7 Q11130 1/20 0.37
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 4/20 0.37
HPGD P15428 4/20 0.37
HSD17B10 Q99714 3/20 0.37
LIPG Q9Y5X9 1/20 0.36
GAA P10253 3/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CTSV O60911 1/20 0.36
CTSL P07711 1/20 0.36
USP2 O75604 1/20 0.36
GLA P06280 1/20 0.36

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
SCHEMBL18141645 1.00 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18139726 1.00 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18141388 1.00 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18141747 1.00 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18139671 1.00 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18140853 1.00 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18141275 1.00 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18139114 1.00 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL1109611 1.00 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1
SCHEMBL18138973 1.00 MAPT (0.44) MAPTTLR8FUT7KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109942219-B Concrete glue reducing agent with slump retaining effect SHANXI GREAT ARCHITECTURAL TECHNOLOGY Co.,Ltd. (CN) 2021-08-31 CN claimed
CN-109942219-B Concrete glue reducing agent with slump retaining effect SHANXI GREAT ARCHITECTURAL TECHNOLOGY Co.,Ltd. (CN) 2021-08-31 CN disclosed
EP-3864963-A1 OILY SUSPENSION AGROCHEMICAL COMPOSITION Kumiai Chemical Industry Co., Ltd. (JP) 2021-08-18 EP disclosed
US-10428194-B2 Modified acrylic resin cured product, and laminate thereof, and production methods therefor MITSUI CHEMICALS, INC. (JP) 2019-10-01 US disclosed
EP-3263635-B1 MODIFIED ACRYLIC RESIN CURED PRODUCT, AND LAMINATE THEREOF, AND PRODUCTION METHODS THEREFOR MITSUI CHEMICALS INC (JP) 2019-09-18 EP disclosed
US-20180030230-A1 MODIFIED ACRYLIC RESIN CURED PRODUCT, AND LAMINATE THEREOF, AND PRODUCTION METHODS THEREFOR MITSUI CHEMICALS, INC. (JP) 2018-02-01 US disclosed
EP-3263635-A1 MODIFIED ACRYLIC RESIN CURED PRODUCT, AND LAMINATE THEREOF, AND PRODUCTION METHODS THEREFOR Mitsui Chemicals, Inc. (JP) 2018-01-03 EP disclosed
EP-3081578-A1 COMPOSITION FOR HYDROPHILIC CURED PRODUCT Mitsui Chemicals, Inc. (JP) 2016-10-19 EP disclosed
US-5688856-A HYDROGENATED BLOCK COPOLYMERS OF CONJUGATED DIENES AND VINYL AROMATIC HYDROCARBONS SHELL OIL COMPANY (US) 1997-11-18 US disclosed
US-5331032-A Hydrophilic aromatic polyester fiber TEIJIN LIMITED (JP) 1994-07-19 US disclosed
US-5262460-A Blend with polyoxyethylene glycol for antistatic fibers, films or sheets TEIJIN LIMITED (JP) 1993-11-16 US disclosed