SCHEMBL34652

SCHEMBL34652

CC[N+](CC)(CC)CCCCS(=O)(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.46
APP P05067 1/20 0.41
SLC22A1 O15245 2/20 0.36
SLC22A2 O15244 1/20 0.36
EPHX2 P34913 1/20 0.35
BBOX1 O75936 1/20 0.33
PTGS1 P23219 1/20 0.33
PDE4A P27815 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
ALOX12 P18054 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 1/20 0.33
SLC6A6 P31641 1/20 0.33
CYP2C19 P33261 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
SCHEMBL34817 0.96 DNM1 (0.43) DNM1APPSLC22A1SLC22A2EPHX2
SCHEMBL9165215 0.93 DNM1 (0.42) DNM1APPSLC22A1SLC22A2EPHX2
SCHEMBL34816 0.92 DNM1 (0.40) DNM1APPSLC22A1SLC22A2EPHX2
Water SCHEMBL918201 0.91 DNM1 (0.41) DNM1APPSLC22A1SLC22A2EPHX2
SCHEMBL34923 0.89 DNM1 (0.39) DNM1APPEPHX2BBOX1PTGS1
Trifluoromethanesulfonic Acid SCHEMBL34531 0.89 DNM1 (0.38) DNM1APPEPHX2
SCHEMBL739462 0.88 DNM1 (0.35) DNM1APPSLC22A1SLC22A2EPHX2
SCHEMBL11880850 0.88 DNM1 (0.56) DNM1SLC22A1SLC22A2EPHX2ALDH1A1
Sulfuric Acid SCHEMBL20573201 0.87 BBOX1 (0.44) DNM1APPEPHX2BBOX1PTGS1
Water SCHEMBL9000170 0.86 DNM1 (0.54) DNM1SLC22A1SLC22A2EPHX2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12584190-B2 Methods for selective recovery of rare earth elements and metals from coal ash by ionic liquids GEORGIA TECH RESEARCH CORPORATION (US) 2026-03-24 US disclosed
CN-114805256-B Method for preparing 5-hydroxymethylfurfural by catalyzing dehydration of fructosyl carbohydrate by using zwitterionic inner salt 广东石油化工学院 2023-12-05 CN disclosed
US-20230357886-A1 Methods for Selective Recovery of Rare Earth Elements and Metals from Coal Ash by Ionic Liquids GEORGIA TECH RESEARCH CORPORATION 2023-11-09 US disclosed
EP-4077748-A1 METHODS FOR SELECTIVE RECOVERY OF RARE EARTH ELEMENTS AND METALS FROM COAL ASH BY IONIC LIQUIDS Georgia Tech Research Corporation (US) 2022-10-26 EP disclosed
CN-114805256-A Method for preparing 5-hydroxymethylfurfural by dehydrating fructosyl carbohydrate under catalysis of zwitterion inner salt 广东石油化工学院 2022-07-29 CN disclosed
EP-3242864-B1 PROCESS OF PRODUCTION OF SPECIFIC KETALS DSM IP ASSETS BV (NL) 2019-08-14 EP disclosed
EP-2473277-B1 PALLADIUM CATALYST SYSTEM COMPRISING ZWITTERION OR ACID-FUNCTIONALIZED IONIC LIQUID UNIV DENMARK TECH DTU (DK) 2019-07-03 EP disclosed
US-20170341067-A1 Palladium Catalyst System Comprising Zwitterion And/Or Acid-Functionalyzed Ionic Liquid UNIV DENMARK TECH DTU (DK) 2017-11-30 US disclosed
US-20170341067-A1 Palladium Catalyst System Comprising Zwitterion And/Or Acid-Functionalyzed Ionic Liquid UNIV DENMARK TECH DTU (DK) 2017-11-30 US disclosed
US-20170341067-A1 Palladium Catalyst System Comprising Zwitterion And/Or Acid-Functionalyzed Ionic Liquid UNIV DENMARK TECH DTU (DK) 2017-11-30 US disclosed
WO-2016110560-A1 PROCESS OF PRODUCTION OF SPECIFIC ACETALS AND KETALS DSM IP ASSETS B.V. (NL) 2016-07-14 WO disclosed
EP-2473277-A1 PALLADIUM CATALYST SYSTEM COMPRISING ZWITTERION AND/OR ACID-FUNCTIONALIZED IONIC LIQUID Technical University of Denmark (DK) 2012-07-11 EP disclosed
US-20110065950-A1 PALLADIUM CATALYST SYSTEM COMPRISING ZWITTERION AND/OR ACID-FUNCTIONALYZED IONIC LIQUID TECHNICAL UNIVERSITY OF DENMARK (DK) 2011-03-17 US disclosed
US-20110065950-A1 PALLADIUM CATALYST SYSTEM COMPRISING ZWITTERION AND/OR ACID-FUNCTIONALYZED IONIC LIQUID TECHNICAL UNIVERSITY OF DENMARK (DK) 2011-03-17 US disclosed
US-20110065950-A1 PALLADIUM CATALYST SYSTEM COMPRISING ZWITTERION AND/OR ACID-FUNCTIONALYZED IONIC LIQUID TECHNICAL UNIVERSITY OF DENMARK (DK) 2011-03-17 US disclosed
WO-2011026860-A1 PALLADIUM CATALYST SYSTEM COMPRISING ZWITTERION AND/OR ACID-FUNCTIONALIZED IONIC LIQUID TECHNICAL UNIVERISTY OF DENMARK (DK) 2011-03-10 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 (3 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-12584190-B2 Methods for selective recovery of rare earth elements and metals from coal ash by ionic liquids CA2, ASH2L, CA1 DNM1 1351/4885APP 3848/4885SLC22A1 2439/4885
US-20110065950-A1 PALLADIUM CATALYST SYSTEM COMPRISING ZWITTERION AND/OR ACID-FUNCTIONALYZED IONIC LIQUID PDCD2L, PCCA, PDK2 DNM1 2304/4885APP 4257/4885SLC22A1 4562/4885
US-20170341067-A1 Palladium Catalyst System Comprising Zwitterion And/Or Acid-Functionalyzed Ionic Liquid PDCD2L, PCCA, PDK2 DNM1 2304/4885APP 4257/4885SLC22A1 4562/4885

“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.