SCHEMBL924012

SCHEMBL924012

O=S(=O)([O-])OS(=O)(=O)OCCO.[Na+]

nearest known ligand 0.33

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 7)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
EPHX2 P34913 1/20 0.33
BLM P54132 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
SCHEMBL923059 0.87 RECQL (0.39) RECQLGLAHPGDTSHRMAPK1
SCHEMBL921710 0.85 RECQL (0.42) RECQLGLAHPGDTSHRMAPK1
SCHEMBL2313305 0.80
SCHEMBL700472 0.77 TSHR (0.39) TSHRMAPK1
Di(Hydroxyethyl)Ether SCHEMBL30327411 0.76 TSHR (0.50) RECQLGLAHPGDTSHRMAPK1
SCHEMBL922332 0.76 CA2 (0.30) TSHRMAPK1
Lithium Ion SCHEMBL16146112 0.75
SCHEMBL7603680 0.75
SCHEMBL4523290 0.75 RECQL (0.43) RECQLGLAHPGDTSHRMAPK1
Potassium Ion SCHEMBL340574 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
US-20030108595-A1 Method for treating amyloidosis QUEEN'S UNIVERSITY AT KINGSTON 2003-06-12 US disclosed
US-20010048941-A1 Method for treating amyloidosis QUEEN'S UNIVERSITY OF KINGSTON 2001-12-06 US 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
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
US-5643562-A ANTIDEPOSIT AGENTS FOR PROTEINS FOR MEDICAL DIAGNOSIS OF DISEASES QUEEN'S UNIVERSITY OF KINGSTON (CA) 1997-07-01 US disclosed
WO-1996039129-A1 METHODS OF INCREASING AMYLOID DEPOSITION QUEEN'S UNIVERSITY AT KINGSTON (CA) 1996-12-12 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 (6 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 RECQL 3591/4885GLA 101/4885HPGD 3358/4885
US-20070265334-A1 Method for treating amyloidosis TTR, IAPP, APP RECQL 3591/4885GLA 101/4885HPGD 3358/4885
US-20030108595-A1 Method for treating amyloidosis TTR, IAPP, APP RECQL 3591/4885GLA 101/4885HPGD 3358/4885
US-20010048941-A1 Method for treating amyloidosis TTR, APOB, NEFM RECQL 4083/4885GLA 216/4885HPGD 3359/4885
US-20040208875-A1 Method for treating amyloidosis TTR, IAPP, APP RECQL 3591/4885GLA 101/4885HPGD 3358/4885
US-20110002875-A1 METHOD FOR TREATING AMYLOIDOSIS TTR, IAPP, APP RECQL 3591/4885GLA 101/4885HPGD 3358/4885

“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.