SCHEMBL921255

SCHEMBL921255

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

nearest known ligand 0.63

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
TSHR P16473 3/20 0.63
ALDH1A1 P00352 2/20 0.63
MAPK1 P28482 2/20 0.63
GMNN O75496 1/20 0.63
LMNA P02545 1/20 0.63
TP53 P04637 1/20 0.63
THPO P40225 1/20 0.63
HBB P68871 1/20 0.63
PMP22 Q01453 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
KDM4E B2RXH2 1/20 0.53
MAPT P10636 1/20 0.53
ALOX15 P16050 1/20 0.53
BBOX1 O75936 3/20 0.50
ENPEP Q07075 2/20 0.46
EPHX2 P34913 2/20 0.40
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
RECQL P46063 2/20 0.33
GLA P06280 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
SCHEMBL3385778 1.00 TSHR (0.63) TSHRALDH1A1MAPK1GMNNLMNA
SCHEMBL3386062 1.00 TSHR (0.63) TSHRALDH1A1MAPK1GMNNLMNA
SCHEMBL2289785 1.00 TSHR (0.63) TSHRALDH1A1MAPK1GMNNLMNA
SCHEMBL917845 0.96 ALDH1A1 (0.67) TSHRALDH1A1MAPK1GMNNLMNA
SCHEMBL11067237 0.93 GMNN (0.55) TSHRALDH1A1MAPK1GMNNLMNA
Lithium Ion SCHEMBL28483872 0.93 GMNN (0.55) TSHRALDH1A1MAPK1GMNNLMNA
SCHEMBL2291877 0.93 GMNN (0.55) TSHRALDH1A1MAPK1GMNNLMNA
SCHEMBL2292185 0.93 GMNN (0.55) TSHRALDH1A1MAPK1GMNNLMNA
Potassium Ion SCHEMBL10537906 0.93 GMNN (0.55) TSHRALDH1A1MAPK1GMNNLMNA
SCHEMBL2288142 0.89 ALDH1A1 (0.58) TSHRALDH1A1MAPK1GMNNLMNA

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
EP-1054664-A1 METHOD FOR MODULATING MACROPHAGE ACTIVATION Neurochem, Inc. (CA) 2000-11-29 EP claimed
WO-1999040909-A1 METHOD FOR MODULATING MACROPHAGE ACTIVATION NEUROCHEM, INC. (CA) 1999-08-19 WO claimed
US-7999009-B2 Strontium salts of sulphonic acids, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2011-08-16 US disclosed
US-20110002875-A1 METHOD FOR TREATING AMYLOIDOSIS BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2011-01-06 US disclosed
US-7754761-B2 Sulfonated compounds and compositions for treating amyloidosis BELLUS HEALTH (INTERNATIONAL) LIMITED (CH) 2010-07-13 US disclosed
US-20070265334-A1 Method for treating amyloidosis NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2007-11-15 US disclosed
US-20070244191-A1 Strontium salts of sulphonic acids, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2007-10-18 US disclosed
US-20060167095-A1 Method for treating amyloidosis QUEEN'S UNIVERSITY AT KINGSTON (CA) 2006-07-27 US disclosed
EP-1614432-A2 Method for treating amyloidosis QUEEN'S UNIVERSITY AT KINGSTON (CA) 2006-01-11 EP disclosed
EP-0814842-B1 METHOD FOR TREATING AMYLOIDOSIS UNIV KINGSTON (CA) 2005-10-12 EP disclosed
US-20040208875-A1 Method for treating amyloidosis QUEEN'S UNIVERSITY AT KINGSTON (CA) 2004-10-21 US disclosed
EP-1054664-A1 METHOD FOR MODULATING MACROPHAGE ACTIVATION Neurochem, Inc. (CA) 2000-11-29 EP disclosed
US-5972328-A INHIBITING AMYLOID DEPOSITION BY ADMINISTERING GLYCEROL TRISULFURIC ACID OR PHARMACEUTICALLY ACCEPTABLE SALT QUEEN'S UNIVERSITY AT KINGSTON (CA) 1999-10-26 US disclosed
WO-1999040909-A1 METHOD FOR MODULATING MACROPHAGE ACTIVATION NEUROCHEM, INC. (CA) 1999-08-19 WO disclosed
US-5858326-A CONTACTING AMYLOIDOGENIC PEPTIDE WITH AMYLOID-ENHANCING COMPOUND COMPRISING AROMATIC MOIETY AND AT LEAST TWO ANIONIC MOIETIES IN VITRO TO FORM AMYLOID FIBRILS NEUROCHEM, INC. (CA) 1999-01-12 US disclosed
US-5840294-A INHIBITING AMYLOID DEPOSITION BY ADMINISTERING A THERAPEUTIC COMPOUND COMPRISING AN ANIONIC GROUP AND A CARRIER MOLECULE QUEEN'S UNIVERSITY AT KINGSTON (CA) 1998-11-24 US disclosed
US-5728375-A ADMINISTERING A COMPOUND COMPRISING AN ANIONIC GROUP AND A CARRIER MOLECULE; INHIBITS DEPOSITION BY PREVENTING INTERACTION BETWEEN AN AMYLOIDOGENIC PROTEIN AND A BASEMENT MEMBRANE CONSTITUENT QUEEN'S UNIVERSITY AT KINGSTON (CA) 1998-03-17 US disclosed
EP-0814842-A1 METHOD FOR TREATING AMYLOIDOSIS Queen's University at Kingston (CA) 1998-01-07 EP disclosed
US-5643562-A ANTIDEPOSIT AGENTS FOR PROTEINS FOR MEDICAL DIAGNOSIS OF DISEASES QUEEN'S UNIVERSITY OF KINGSTON (CA) 1997-07-01 US disclosed
WO-1996028187-A1 METHOD FOR TREATING AMYLOIDOSIS QUEEN'S UNIVERSITY AT KINGSTON (CA) 1996-09-19 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 (4 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-20060167095-A1 Method for treating amyloidosis TTR, IAPP, APP TSHR 3807/4885ALDH1A1 2877/4885MAPK1 2612/4885
US-20070265334-A1 Method for treating amyloidosis TTR, IAPP, APP TSHR 3807/4885ALDH1A1 2877/4885MAPK1 2612/4885
US-20040208875-A1 Method for treating amyloidosis TTR, IAPP, APP TSHR 3807/4885ALDH1A1 2877/4885MAPK1 2612/4885
US-20110002875-A1 METHOD FOR TREATING AMYLOIDOSIS TTR, IAPP, APP TSHR 3807/4885ALDH1A1 2877/4885MAPK1 2612/4885

“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.