SCHEMBL28513985

SCHEMBL28513985

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

nearest known ligand 0.38

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 6)

geneUniProtsupporting neighboursconfidence
THRB known ✓ P10828 1/20 0.33
TP53 P04637 1/20 0.38
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 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
SCHEMBL1695398 0.86 MEN1 (0.39) TP53MEN1ALDH1A1TSHRKMT2A
SCHEMBL6689822 0.85 TP53 (0.35) TP53MEN1ALDH1A1TSHRKMT2A
SCHEMBL8441359 0.81 MEN1 (0.35) TP53MEN1ALDH1A1TSHRKMT2A
SCHEMBL28098009 0.78
SCHEMBL15420991 0.77 MEN1 (0.32) TP53MEN1ALDH1A1TSHRKMT2A
SCHEMBL28534407 0.77 TSHR (0.41) TP53MEN1ALDH1A1TSHRKMT2A
SCHEMBL6838775 0.76 TP53 (0.39) TP53MEN1ALDH1A1TSHRKMT2A
Sulfuric Acid SCHEMBL922031 0.76 THRB (0.48) TP53THRBMEN1ALDH1A1TSHR
SCHEMBL29994889 0.75 CA1 (0.39) MEN1ALDH1A1TSHRKMT2A
SCHEMBL25231278 0.75 THRB (0.38) TP53THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025108924-A1 WATER-DISPERSIBLE BLOCKED ISOCYANATE PREPOLYMER SYSTEM, METHOD FOR PREPARING THE SAME, AND APPLICATION THEREOF COVESTRO DEUTSCHLAND AG (DE) 2025-05-30 WO claimed
CN-115819714-A Preparation method and application of waterborne polyurethane composition 万华化学集团股份有限公司 2023-03-21 CN claimed
CN-115109219-A Multiple self-crosslinking type water-based hybrid resin and preparation method and application thereof 烟台金桥优尼科新材料科技有限公司 2022-09-27 CN claimed
CN-114181353-A Synthesis and application of modified waterborne polyurethane composition 万华化学集团股份有限公司 2022-03-15 CN claimed
CN-114106285-A Multiple self-crosslinking type water-based hybrid resin and preparation method and application thereof 烟台金桥优尼科新材料科技有限公司 2022-03-01 CN claimed
CN-113956430-A Waterborne polyurethane adhesive resin and preparation method thereof 广州市纬庆化工科技有限公司 2022-01-21 CN claimed
CN-112321774-A Waterborne polyurethane/acrylate composite emulsion for single-component plastic silver paint and preparation method thereof 湖北双键精细化工有限公司 2021-02-05 CN claimed
WO-2025108924-A1 WATER-DISPERSIBLE BLOCKED ISOCYANATE PREPOLYMER SYSTEM, METHOD FOR PREPARING THE SAME, AND APPLICATION THEREOF COVESTRO DEUTSCHLAND AG (DE) 2025-05-30 WO disclosed
CN-112321774-B Waterborne polyurethane/acrylate composite emulsion for single-component plastic silver paint and preparation method thereof 湖北双键精细化工有限公司 2023-01-24 CN disclosed
CN-115109219-A Multiple self-crosslinking type water-based hybrid resin and preparation method and application thereof 烟台金桥优尼科新材料科技有限公司 2022-09-27 CN disclosed
CN-114106285-A Multiple self-crosslinking type water-based hybrid resin and preparation method and application thereof 烟台金桥优尼科新材料科技有限公司 2022-03-01 CN disclosed
CN-112661933-A Preparation method of reactive waterborne polyurethane 武汉弘毅共聚新材料科技有限公司 2021-04-16 CN disclosed
CN-112321774-A Waterborne polyurethane/acrylate composite emulsion for single-component plastic silver paint and preparation method thereof 湖北双键精细化工有限公司 2021-02-05 CN disclosed