SCHEMBL3936738

SCHEMBL3936738

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

nearest known ligand 0.48

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 4/20 0.48
CA4 known ✓ P22748 2/20 0.48
CA12 known ✓ O43570 3/20 0.39
CA1 known ✓ P00915 2/20 0.39
PTGS2 known ✓ P35354 2/20 0.38
CES1 P23141 4/20 0.42
ALDH1A1 P00352 3/20 0.42
TSHR P16473 3/20 0.42
CES2 O00748 2/20 0.42
DAO P14920 1/20 0.42
NAPRT Q6XQN6 1/20 0.42
MAPT P10636 3/20 0.41
HSD17B10 Q99714 2/20 0.41
ALOX15 P16050 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
CA9 Q16790 3/20 0.39
CYP2C19 P33261 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CYP1A2 P05177 1/20 0.39

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
SCHEMBL11656744 0.79 MAPT (0.42) CA2CA4MAPTLMNACA12
SCHEMBL27416482 0.78 CA2 (0.52) CA2CA4CES1ALDH1A1TSHR
SCHEMBL7560712 0.76 MAPT (0.47) CA2CA4ALDH1A1TSHRMAPT
SCHEMBL13585850 0.76 PTGS2 (0.36) CA2CA4ALDH1A1LMNACA12
SCHEMBL27906892 0.76 CA2 (0.44) CA2CA4CES1ALDH1A1TSHR
SCHEMBL8670664 0.76 TSHR (0.48) CA2CA4ALDH1A1TSHRLMNA
SCHEMBL285311 0.74 TSHR (0.48) CA2CA4CES1ALDH1A1TSHR
SCHEMBL25421400 0.73 TSHR (0.47) CA2CES1ALDH1A1TSHRCES2
Benzoic Acid SCHEMBL10821883 0.73 TSHR (0.67) CA2CA4CES1ALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL1411437 0.72 TSHR (0.46) CA2CA4CES1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120059168-A Dyeing auxiliary and easy-to-dye polyurethane urea elastic fiber containing same 华峰化学股份有限公司 2025-05-30 CN claimed
CN-119708965-A Plasma cutting protection liquid and preparation method and application thereof 深圳市化讯半导体材料有限公司 2025-03-28 CN claimed
CN-119661992-A Low-temperature extinction transparent polyester resin composition, and preparation method and application thereof 擎天材料科技有限公司 2025-03-21 CN claimed
CN-115506030-B Monocrystalline silicon wet etching texturing additive, monocrystalline silicon wet etching texturing liquid containing monocrystalline silicon wet etching texturing additive, preparation method and application of monocrystalline silicon wet etching texturing additive 浙江奥首材料科技有限公司 2024-02-27 CN claimed
CN-115584662-B Paper-plastic protection piece for furniture corner positions, preparation method and paper-plastic protection assembly structure 东莞市加隆纸塑包装有限公司 2023-10-27 CN claimed
CN-120059168-A Dyeing auxiliary and easy-to-dye polyurethane urea elastic fiber containing same 华峰化学股份有限公司 2025-05-30 CN disclosed
CN-119661992-A Low-temperature extinction transparent polyester resin composition, and preparation method and application thereof 擎天材料科技有限公司 2025-03-21 CN disclosed
CN-115506030-B Monocrystalline silicon wet etching texturing additive, monocrystalline silicon wet etching texturing liquid containing monocrystalline silicon wet etching texturing additive, preparation method and application of monocrystalline silicon wet etching texturing additive 浙江奥首材料科技有限公司 2024-02-27 CN disclosed
CN-115506030-B Monocrystalline silicon wet etching texturing additive, monocrystalline silicon wet etching texturing liquid containing monocrystalline silicon wet etching texturing additive, preparation method and application of monocrystalline silicon wet etching texturing additive 浙江奥首材料科技有限公司 2024-02-27 CN disclosed
CN-115584662-B Paper-plastic protection piece for furniture corner positions, preparation method and paper-plastic protection assembly structure 东莞市加隆纸塑包装有限公司 2023-10-27 CN disclosed
WO-2009017288-A1 PROCESS FOR PREPARATION OF DISODIUM STILBENEDISULFONATES SK ENERGY CO., LTD. (KR) 2009-02-05 WO disclosed
EP-1687101-A4 VEHICLE IDENTIFICATION MARKING SYSTEM RODRIGUEZ MILTON (US) 2007-08-08 EP disclosed
EP-1246899-A1 PRO-PERFUME COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2002-10-09 EP disclosed
EP-1117757-A1 LAUNDRY DETERGENT AND/OR FABRIC CARE COMPOSITIONS COMPRISING A CHEMICAL ENTITY, WHICH CONTAINS A DEPOSITION AID, AND A POLYMER THE PROCTER & GAMBLE COMPANY (US) 2001-07-25 EP disclosed
WO-2001051599-A1 PRO-PERFUME COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2001-07-19 WO disclosed
WO-2000018865-A1 LAUNDRY DETERGENT AND/OR FABRIC CARE COMPOSITIONS COMPRISING A CHEMICAL ENTITY, WHICH CONTAINS A DEPOSITION AID, AND A POLYMER THE PROCTER & GAMBLE COMPANY (US) 2000-04-06 WO disclosed
WO-1997045513-A9 DETERGENT COMPOSITION 1998-03-12 WO disclosed
WO-1995025159-A1 BLEACH IMPROVEMENT WITH MANGANESE ETHYLENEDIAMINE-N,N'-DISUCCINATE THE PROCTER & GAMBLE COMPANY (US) 1995-09-21 WO disclosed
EP-0405967-A2 Built liquid detergent compositions Amway Corporation (US) 1991-01-02 EP disclosed
EP-0385562-A2 Laundry detergent composition Amway Corporation (US) 1990-09-05 EP disclosed