SCHEMBL29557352

SCHEMBL29557352

O=S(=O)([O-])c1ccc2ccc3cccc4ccc1c2c34.[Na+]

nearest known ligand 0.46

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 2/20 0.40
NR4A1 P22736 1/20 0.46
ALDH1A1 P00352 6/20 0.44
HPGD P15428 5/20 0.44
HSD17B10 Q99714 4/20 0.44
CYP3A4 P08684 2/20 0.44
TSHR P16473 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
DUSP5 Q16690 1/20 0.42
CYP1A2 P05177 4/20 0.42
CYP1A1 P04798 1/20 0.42
CYP1B1 Q16678 1/20 0.42
ERBB2 P04626 1/20 0.41
FYN P06241 1/20 0.41
MAOA P21397 1/20 0.41
ACHE P22303 1/20 0.41
AHR P35869 1/20 0.41
KDM4E B2RXH2 2/20 0.39
MAPT P10636 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
SCHEMBL592127 1.00 NR4A1 (0.46) NR4A1ALDH1A1HPGDHSD17B10CYP3A4
SCHEMBL31441383 1.00 NR4A1 (0.46) NR4A1ALDH1A1HPGDHSD17B10CYP3A4
SCHEMBL27823784 0.92 CTRB1 (0.44) NR4A1ALDH1A1HPGDHSD17B10CYP3A4
Potassium Ion SCHEMBL11528259 0.88 NR4A1 (0.47) NR4A1ALDH1A1HPGDHSD17B10CYP3A4
SCHEMBL11528709 0.87 THRB (0.47) NR4A1ALDH1A1HPGDHSD17B10CYP3A4
SCHEMBL18274827 0.87 DUSP5 (0.45) NR4A1ALDH1A1HPGDHSD17B10CYP3A4
SCHEMBL450356 0.85 NR4A1 (0.39) NR4A1ALDH1A1HPGDHSD17B10CYP3A4
SCHEMBL221346 0.85 NR4A1 (0.39) NR4A1ALDH1A1HPGDHSD17B10CYP3A4
SCHEMBL27939682 0.85 DUSP5 (0.47) NR4A1ALDH1A1HPGDHSD17B10CYP3A4
SCHEMBL30538112 0.85 THRB (0.43) NR4A1ALDH1A1HPGDHSD17B10CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260138875-A1 Methods And Systems For Processing And Recycling Of Carbonaceous Materials NANOTECH ENERGY INC (US) 2026-05-21 US claimed
WO-2025049276-A1 METHODS AND SYSTEMS FOR PROCESSING AND RECYCLING OF CARBONACEOUS MATERIALS NANOTECH ENERGY, INC. (US) 2025-03-06 WO claimed
CN-112661973-B Preparation and structure of calixadine and pyrene sulfonate supramolecular nanoparticles and application of calixadine and pyrene sulfonate supramolecular nanoparticles in induced aggregation luminescence 天津师范大学 2022-12-06 CN claimed
CN-111808078-B Lenalidomide derivative for inhibiting IDO1 activity and preparation method and application thereof 济南爱思医药科技有限公司 2022-10-11 CN claimed
CN-114901754-A Methods and compositions for producing graphene polyurethane foams 普世物料公司 2022-08-12 CN claimed
EP-4034600-A1 METHODS AND COMPOSITIONS FOR PRODUCING GRAPHENE POLYURETHANE FOAMS Universal Matter Inc. (CA) 2022-08-03 EP claimed
CN-111875589-B Indirubin derivative used in combination with polypeptide and preparation method and application thereof 济南爱思医药科技有限公司 2022-07-15 CN claimed
US-12640279-B2 Viscoelastic conductive hydrogel PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2026-05-26 US disclosed
US-20260138875-A1 Methods And Systems For Processing And Recycling Of Carbonaceous Materials NANOTECH ENERGY INC (US) 2026-05-21 US disclosed
CN-119570478-B Indicator replacement sensor for detecting perfluorooctane sulfonic acid, and preparation method and application thereof 三峡环境科技有限公司 2025-06-03 CN disclosed
CN-119570478-A Indicator replacement sensor for detecting perfluorooctane sulfonic acid, and preparation method and application thereof 三峡环境科技有限公司 2025-03-07 CN disclosed
WO-2025049276-A1 METHODS AND SYSTEMS FOR PROCESSING AND RECYCLING OF CARBONACEOUS MATERIALS NANOTECH ENERGY, INC. (US) 2025-03-06 WO disclosed
CN-118362732-B Plasma protein enrichment and mass spectrum identification method based on pyrenesulfonic acid modified magnetic spiral multi-wall carbon nano tube 嘉华药锐生物科技(昆山)有限公司 2025-01-24 CN disclosed
CN-115015192-A Gold nanoparticle-based sensor and detection method of glutathione and oxidation degree thereof 扬州大学 2022-09-06 CN disclosed
CN-114901754-A Methods and compositions for producing graphene polyurethane foams 普世物料公司 2022-08-12 CN disclosed
EP-4034600-A1 METHODS AND COMPOSITIONS FOR PRODUCING GRAPHENE POLYURETHANE FOAMS Universal Matter Inc. (CA) 2022-08-03 EP disclosed
CN-111875589-B Indirubin derivative used in combination with polypeptide and preparation method and application thereof 济南爱思医药科技有限公司 2022-07-15 CN disclosed
WO-2022123499-A1 GRAPHENE COMPOSITE MATERIALS AND METHODS FOR PRODUCTION THEREOF UNIVERSAL MATTER INC. (CA) 2022-06-16 WO disclosed
CN-110698326-B Synthesis method of 1-hydroxypyrene 福建福瑞明德药业有限公司 2022-04-26 CN disclosed
WO-2022081527-A1 VISCOELASTIC CONDUCTIVE HYDROGEL PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2022-04-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12640279-B2 Viscoelastic conductive hydrogel CD44, COL2A1, TNNT2 THRB 1310/4885NR4A1 4125/4885ALDH1A1 2147/4885
US-20260138875-A1 Methods And Systems For Processing And Recycling Of Carbonaceous Materials WNT3A, CACNA2D4, CACNA2D3 THRB 3126/4885NR4A1 4023/4885ALDH1A1 4405/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.