SCHEMBL64468

SCHEMBL64468

O=S([O-])c1ccccc1.[Na+]

nearest known ligand 0.37

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
CA4 known ✓ P22748 2/20 0.36
CA2 known ✓ P00918 1/20 0.36
EPHX1 P07099 2/20 0.37
HPGD P15428 1/20 0.37
EPHX2 P34913 1/20 0.36
ALDH1A1 P00352 3/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
LOX P28300 1/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
DUSP3 P51452 1/20 0.31
PTPN5 P54829 1/20 0.31
PTPN11 Q06124 1/20 0.31
KEAP1 Q14145 1/20 0.31

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
SCHEMBL5702427 1.00 EPHX1 (0.37) EPHX1HPGDCA4EPHX2CA2
SCHEMBL10724821 1.00 EPHX1 (0.37) EPHX1HPGDCA4EPHX2CA2
SCHEMBL8090124 1.00 EPHX1 (0.37) EPHX1HPGDCA4EPHX2CA2
SCHEMBL8456561 0.97 EPHX1 (0.35) EPHX1HPGDCA4EPHX2CA2
Water SCHEMBL459187 0.97 EPHX1 (0.35) EPHX1HPGDCA4EPHX2CA2
Water SCHEMBL10833314 0.97 EPHX1 (0.35) EPHX1HPGDCA4EPHX2CA2
SCHEMBL8456565 0.97 EPHX1 (0.35) EPHX1HPGDCA4EPHX2CA2
Potassium Ion SCHEMBL7553988 0.97 EPHX1 (0.35) EPHX1HPGDCA4EPHX2CA2
Lithium Ion SCHEMBL1021741 0.94 EPHX1 (0.37) EPHX1HPGDCA4EPHX2CA2
SCHEMBL1022858 0.94 EPHX1 (0.37) EPHX1HPGDCA4EPHX2CA2

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

Appears in 4579 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122037569-A Preparation method of high-fluidity polyphenylene sulfide resin 福州大学 2026-05-15 CN claimed
CN-122029142-A Improved process for synthesizing all (E) -heptaisopentenol (C35-OH) 辛纳吉亚生命科学私人有限公司 2026-05-12 CN claimed
CN-121575460-A Preparation method of TiAl alloy matrix surface composite coating and TiAl alloy 季华实验室 2026-02-27 CN claimed
US-12370129-B2 Storage-stable dental adhesive set for use with peroxidically and hydroperoxidically redox-initiated composites IVOCLAR VIVADENT AG (LI) 2025-07-29 US claimed
CN-120192248-A Alkenyl nitrile compound and preparation method thereof 武汉光化学技术研究院 2025-06-24 CN claimed
CN-120138738-A Electronic plating cobalt additive composition for hole filling and application thereof 厦门大学 2025-06-13 CN claimed
CN-116947780-B Preparation method of thiazolidine-4-thioketone derivative 华侨大学 2025-06-03 CN claimed
CN-120058628-A Process and intermediates for preparing D1 PAM I 伊莱利利公司 2025-05-30 CN claimed
CN-120060937-A TiAl alloy surface Ni coating and preparation method thereof 季华实验室 2025-05-30 CN claimed
WO-2025074315-A2 AN IMPROVED PROCESS FOR THE SYNTHESIS OF ALL (E)-HEPTA PRENOL (C35-OH) SYNERGIA LIFE SCIENCES PVT. LTD. (IN) 2025-04-10 WO claimed
CN-1058430-A Electroplating process for protective decorative coating HARDWARE BUILDING MATERIALS MA (CN) 1992-02-05 CN claimed
US-5043469-A Process for preparing 5-substituted aminophenols EASTMAN KODAK COMPANY (US) 1991-08-27 US claimed
WO-1991001300-A1 5-SUBSTITUTED AMINOPHENOLS EASTMAN KODAK COMPANY (US) 1991-02-07 WO claimed
US-4650913-A FLUOROALKYLATION, IODINATION E. I. DU PONT DE NEMOURS AND COMPANY (US) 1987-03-17 US claimed
EP-0058483-B1 DENTIN AND ENAMEL ADHESIVES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1986-10-15 EP claimed
US-4182035-A Adhesive compositions for the hard tissues of the human body KURARAY COMPANY LIMITED (JP) 1980-01-08 US claimed
US-4140532-A ORGANIC SILVER SALT, CATALYST, REDUCING AGENT, 2H-1,3-BENZOTHIAZIN-2,4(3H-)DIONE FUJI PHOTO FILM CO., LTD. (JP) 1979-02-20 US claimed
US-4110270-A ALKALI METAL SALT OF TOLUENE- OR BENZENE-SULFINIC ACID AS CATALYST BASF WYANDOTTE CORPORATION (US) 1978-08-29 US claimed
US-4039334-A ORGANIC SILVER SALT AND HALIDE, REDUCING AGENT, ROSIN FUJI PHOTO FILM CO., LTD. (JA) 1977-08-02 US claimed
US-4036647-A Package for making photopolymerized plates HUGHES AIRCRAFT COMPANY (US) 1977-07-19 US claimed