SCHEMBL339834

SCHEMBL339834

Nc1ccc(N=Nc2ccc(S(=O)(=O)[O-])cc2)cc1S(=O)(=O)[O-].[Na+].[Na+]

nearest known ligand 0.52

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
THRB known ✓ P10828 1/20 0.43
CA12 known ✓ O43570 3/20 0.43
CA2 known ✓ P00918 3/20 0.43
PTGS1 known ✓ P23219 3/20 0.42
PTGS2 known ✓ P35354 3/20 0.42
SLC7A11 Q9UPY5 3/20 0.52
PLCG1 P19174 1/20 0.50
APP P05067 2/20 0.46
GLB1 P16278 1/20 0.46
CHAT P28329 1/20 0.46
ENPP2 Q13822 1/20 0.46
PHLPP2 Q6ZVD8 1/20 0.46
CTRC Q99895 1/20 0.46
CA9 Q16790 3/20 0.43
MAPT P10636 3/20 0.41
TDP1 Q9NUW8 3/20 0.41
USP2 O75604 3/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LTA P01374 2/20 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
SCHEMBL4881910 1.00 SLC7A11 (0.52) SLC7A11PLCG1APPGLB1CHAT
SCHEMBL29837421 0.89 SENP2 (0.50) SLC7A11PLCG1APPGLB1CHAT
SCHEMBL22974903 0.89 SENP2 (0.53) SLC7A11PLCG1APPGLB1CHAT
SCHEMBL11202854 0.82 PTGS1 (0.53) SLC7A11PLCG1APPGLB1CHAT
SCHEMBL11200679 0.82 CA12 (0.51) SLC7A11PLCG1APPGLB1CHAT
SCHEMBL11200690 0.82 CA12 (0.51) SLC7A11PLCG1APPGLB1CHAT
SCHEMBL11202850 0.82 PTGS1 (0.53) SLC7A11PLCG1APPGLB1CHAT
SCHEMBL8772805 0.80 LMNA (0.47) SLC7A11CA12CA2CA9MAPT
SCHEMBL2394481 0.78 CA12 (0.68) SLC7A11PLCG1THRBCA12CA2
SCHEMBL9618266 0.78 CA12 (0.68) SLC7A11PLCG1THRBCA12CA2

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 3053 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260146170-A1 THREE-DIMENSIONALLY PRINTED PARTS AND SECOND-GENERATION PRODUCTS FORMED THEREFROM PERIDOT PRINT LLC (US) 2026-05-28 US claimed
US-20260114758-A1 PAPER-BASED WEARABLE PATCHES FOR REAL-TIME, QUANTITATIVE LACTATE MONITORING Trustees of Tuffs College (US) 2026-04-30 US claimed
EP-4701617-A1 METHOD FOR DYEING KERATIN FIBERS, COMPRISING THE USE OF A DYE CONTAINING CHITOSANE AND A DYEING COMPOUND, AND THE USE OF AN AFTERTREATMENT AGENT CONTAINING PROTEIN HYDROLYSATE AND/OR AMINO ACID Henkel AG & Co. KGaA (DE) 2026-03-04 EP claimed
EP-4701618-A1 METHOD FOR DYEING KERATIN FIBERS, COMPRISING THE USE OF A DYE CONTAINING CHITOSANE AND A DYEING COMPOUND, AND THE USE OF A SHAMPOO Henkel AG & Co. KGaA (DE) 2026-03-04 EP claimed
EP-3723864-B1 THICKENED ONE-COMPONENT HAIR TONER HENKEL AG & CO KGAA (DE) 2026-01-14 EP claimed
US-12516471-B1 Methods of imparting color to nylon substrates SOUTHWIRE COMPANY, LLC (US) 2026-01-06 US claimed
EP-4661753-A2 PAPER-BASED WEARABLE PATCHES FOR REAL-TIME, QUANTITATIVE LACTATE MONITORING Trustees Of Tufts College (US) 2025-12-17 EP claimed
EP-4644463-A9 COLORED NYLON AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF China Petroleum & Chemical Corporation (CN) 2025-12-17 EP claimed
EP-4644463-A1 COLORED NYLON AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF China Petroleum & Chemical Corporation (CN) 2025-11-05 EP claimed
EP-4398865-B1 MAKEUP KIT COMPRISING AN AQUEOUS MAKEUP COMPOSITION AND A CONTINUOUS OILY-PHASE FIXING COMPOSITION WITH A HYDROPHOBIC FILM-FORMING POLYMER OREAL (FR) 2025-10-29 EP claimed
CN-114232047-A Method for coloring anodic oxidation layer of aluminum alloy 惠州市安泰普表面处理科技有限公司 2022-03-25 CN claimed
CN-109575689-B Ink for ink jet printing, ink set for ink jet printing, and printing method 精工爱普生株式会社 2022-03-25 CN claimed
CN-114222555-A Additives for colorants and methods of use thereof 生活实验公司 2022-03-22 CN claimed
CN-114213900-A Watercolor ink capable of halation dyeing and multiple color folding and paper breaking and preparation method thereof 广东肇庆市红鹰科技有限公司 2022-03-22 CN claimed
CN-216023778-U Environment-friendly dust removal device for producing high-sunlight-resistance and friction-resistance weak-acid yellow dye 长兴保隆新材料科技有限公司 2022-03-15 CN claimed
CN-114152556-A Leukocyte hemolytic agent, preparation method and blood cell analyzer 深圳市国赛生物技术有限公司 2022-03-08 CN claimed
WO-2022043560-A1 PEELABLE WRITING INK COMPOSITION WITH COLOR-CHANGING FOR WRITING POROUS SUBSTRATES SOCIETE BIC (FR) 2022-03-03 WO claimed
CN-109321037-B Ink for ink jet textile printing and ink set for ink jet textile printing 精工爱普生株式会社 2022-02-15 CN claimed
CN-113980488-A Yellow dye, preparation method thereof, yellow color paste containing yellow dye, color photoresist and optical filter 山东凯瑞尔光电科技有限公司 2022-01-28 CN claimed
EP-2930126-B1 Fashionable aerosol dye HENKEL AG & CO KGAA (DE) 2019-10-09 EP claimed