Saccharin

Saccharin

SCHEMBL1018905

O.O=C1NS(=O)(=O)c2ccccc21.O=C1NS(=O)(=O)c2ccccc21.O=C1NS(=O)(=O)c2ccccc21.[Fe]

nearest known ligand 0.92

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO

The experimentally established mechanism targets of Saccharin. 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
ACVR1 known ✓ Q04771 1/20 0.52
CA12 O43570 7/20 0.92
CA9 Q16790 7/20 0.92
CA2 P00918 5/20 0.92
CA1 P00915 4/20 0.92
CA7 P43166 3/20 0.92
KDM4E B2RXH2 3/20 0.92
CA4 P22748 2/20 0.92
USP2 O75604 1/20 0.92
LMNA P02545 1/20 0.92
BCHE P06276 1/20 0.92
CA6 P23280 1/20 0.92
CA5A P35218 1/20 0.92
KMT2A Q03164 1/20 0.92
CA14 Q9ULX7 1/20 0.92
CA5B Q9Y2D0 1/20 0.92
ALDH1A1 P00352 3/20 0.56
RET P07949 2/20 0.52
GRK5 P34947 2/20 0.52
TYRO3 Q06418 2/20 0.52

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
Saccharin SCHEMBL27530252 1.00 CA12 (0.92) CA12CA9CA2CA1CA7
Saccharin SCHEMBL8728937 0.98 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL28835159 0.98 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL1286764 0.98 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL29453372 0.98 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL17888788 0.98 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL28876486 0.98 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL435836 0.98 CA12 (0.96) CA12CA9CA2CA1CA7
Saccharin SCHEMBL29646267 0.96 CA12 (0.92) CA12CA9CA2CA1CA7
Saccharin SCHEMBL485939 0.96 CA12 (0.92) CA12CA9CA2CA1CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1169062-B1 HEAT STABLE COATED COLLOIDAL IRON OXIDES AMAG PHARMACEUTICALS INC (US) 2009-10-21 EP claimed
EP-1522318-A2 Heat stable coated colloidal iron oxides ADVANCED MAGNETICS INCORPORATED (US) 2005-04-13 EP claimed
US-20030225033-A1 Heat stable colloidal iron oxides coated with reduced carbohydrates and uses thereof COVIS PHARMA GMBH (CH) 2003-12-04 US claimed
US-6599498-B1 Enhanced magnetic resonance imaging agent and a hematinic agent; carboxyalkylated reduced polysaccharides coated ultrasmall superparamagnetic iron oxides; carboxymethyl reduced dextran as a plasma extender ADVANCED MAGNETICS, INC. 2003-07-29 US claimed
JP-2002541218-A 2002-12-03 JP claimed
EP-1169062-A2 HEAT STABLE COATED COLLOIDAL IRON OXIDES ADVANCED MAGNETICS INCORPORATED (US) 2002-01-09 EP claimed
WO-2000061191-A9 HEAT STABLE COATED COLLOIDAL IRON OXIDES ADVANCED MAGNETICS INC (US) 2001-06-21 WO claimed
WO-2000061191-A2 HEAT STABLE COATED COLLOIDAL IRON OXIDES ADVANCED MAGNETICS, INC. (US) 2000-10-19 WO claimed
US-20230008240-A1 METHODS AND COMPOSITIONS FOR ADMINISTRATION OF IRON AMERICAN REGENT, INC. (US) 2023-01-12 US disclosed
US-11364260-B2 Methods and compositions for administration of iron AMERICAN REGENT, INC. (US) 2022-06-21 US disclosed
US-11344568-B2 Methods and compositions for administration of iron AMERICAN REGENT, INC. (US) 2022-05-31 US disclosed
US-20200215097-A1 METHODS AND COMPOSITIONS FOR ADMINSTRATION OF IRON AMERICAN REGENT, INC. 2020-07-09 US disclosed
US-20200215096-A1 METHODS AND COMPOSITIONS FOR ADMINISTRATION OF IRON AMERICAN REGENT, INC. 2020-07-09 US disclosed
US-10478450-B2 Methods and compositions for administration of iron LUITPOLD PHARMACEUTICALS, INC. (US) 2019-11-19 US disclosed
US-20030225033-A1 Heat stable colloidal iron oxides coated with reduced carbohydrates and uses thereof COVIS PHARMA GMBH (CH) 2003-12-04 US disclosed
US-6599498-B1 Enhanced magnetic resonance imaging agent and a hematinic agent; carboxyalkylated reduced polysaccharides coated ultrasmall superparamagnetic iron oxides; carboxymethyl reduced dextran as a plasma extender ADVANCED MAGNETICS, INC. 2003-07-29 US disclosed
EP-1169062-A2 HEAT STABLE COATED COLLOIDAL IRON OXIDES ADVANCED MAGNETICS INCORPORATED (US) 2002-01-09 EP disclosed
WO-2000061191-A9 HEAT STABLE COATED COLLOIDAL IRON OXIDES ADVANCED MAGNETICS INC (US) 2001-06-21 WO disclosed
WO-2000061191-A2 HEAT STABLE COATED COLLOIDAL IRON OXIDES ADVANCED MAGNETICS, INC. (US) 2000-10-19 WO disclosed
US-5204457-A Used in nuclear magnetic resonance imaging; forming carboxy-alkylether of a polysaccharide and complexing with magnetic metal oxide MEITO SANGYO KABUSHIKI KAISHA (JP) 1993-04-20 US 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 (1 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-20030225033-A1 Heat stable colloidal iron oxides coated with reduced carbohydrates and uses thereof TFRC, FUCA2, FTH1 ACVR1 4216/4885CA12 105/4885CA9 612/4885

“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.