SCHEMBL2549484

SCHEMBL2549484

C[N+](C)(CCO)CC(O)CS(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 2/20 0.50
PLA2G1B P04054 2/20 0.50
MMP2 P08253 2/20 0.50
ATG4B Q9Y4P1 2/20 0.50
HSP90AA1 P07900 1/20 0.50
RAD52 P43351 1/20 0.35
DNM1 Q05193 2/20 0.31
APAF1 O14727 1/20 0.30
POLB P06746 1/20 0.30
GRK2 P25098 1/20 0.30
DNMT1 P26358 1/20 0.30
PTPN7 P35236 1/20 0.30
RECQL P46063 1/20 0.30
BLM P54132 1/20 0.30
PPP1CA P62136 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30
PTPN22 Q9Y2R2 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30

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
Water SCHEMBL9242383 0.98 PSMD14 (0.49) PSMD14PLA2G1BMMP2ATG4BHSP90AA1
SCHEMBL8712214 0.85 PSMD14 (0.50) PSMD14PLA2G1BMMP2ATG4BHSP90AA1
SCHEMBL17991834 0.81 PSMD14 (0.47) PSMD14PLA2G1BMMP2ATG4BHSP90AA1
Water SCHEMBL9246364 0.81 PSMD14 (0.32) PSMD14PLA2G1BMMP2ATG4BHSP90AA1
SCHEMBL2841240 0.80 APP (0.36) PSMD14PLA2G1BMMP2ATG4BHSP90AA1
SCHEMBL12715831 0.80 PSMD14 (0.33) PSMD14PLA2G1BMMP2ATG4BHSP90AA1
SCHEMBL13133627 0.79 MAPT (0.43) BLMLMNA
SCHEMBL6237613 0.79 PLA2G1B (0.53) PSMD14PLA2G1BMMP2ATG4BHSP90AA1
SCHEMBL10937702 0.79 PLA2G1B (0.53) PSMD14PLA2G1BMMP2ATG4BHSP90AA1
SCHEMBL11770996 0.79 PLA2G1B (0.53) PSMD14PLA2G1BMMP2ATG4BHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962338-B2 Methods for measurement of calcium ions ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2015-02-24 US claimed
EP-2553469-B1 METHOD FOR MEASUREMENT OF CALCIUM IONS ROCHE DIAGNOSTICS GMBH (DE) 2015-01-14 EP claimed
EP-2553469-A1 METHOD FOR MEASUREMENT OF CALCIUM IONS Roche Diagniostics GmbH (DE) 2013-02-06 EP claimed
US-20130023055-A1 METHODS FOR MEASUREMENT OF CALCIUM IONS ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2013-01-24 US claimed
WO-2011120913-A1 METHOD FOR MEASUREMENT OF CALCIUM IONS ROCHE DIAGNOSTICS GMBH (DE) 2011-10-06 WO claimed
US-8962338-B2 Methods for measurement of calcium ions ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2015-02-24 US disclosed
EP-2553469-B1 METHOD FOR MEASUREMENT OF CALCIUM IONS ROCHE DIAGNOSTICS GMBH (DE) 2015-01-14 EP disclosed
EP-2553469-A1 METHOD FOR MEASUREMENT OF CALCIUM IONS Roche Diagniostics GmbH (DE) 2013-02-06 EP disclosed
US-20130023055-A1 METHODS FOR MEASUREMENT OF CALCIUM IONS ROCHE DIAGNOSTICS OPERATIONS, INC. (US) 2013-01-24 US disclosed
WO-2011120913-A1 METHOD FOR MEASUREMENT OF CALCIUM IONS ROCHE DIAGNOSTICS GMBH (DE) 2011-10-06 WO disclosed
US-7732146-B2 Method for screening an agent that modulates activity of macrophage migration inhibitory factor AVANIR PHARMACEUTICALS (US) 2010-06-08 US disclosed
EP-1389110-B1 INHIBITORS OF MACROPHAGE MIGRATION INHIBITORY FACTOR AND METHODS FOR IDENTIFYING THE SAME AVANIR PHARMACEUTICALS (US) 2010-03-24 EP disclosed
EP-0999850-A2 METHODS AND COMPOSITIONS FOR REGULATING NUCLEAR TRAFFICKING OF PROTEINS Ciblex Corporation (US) 2000-05-17 EP disclosed
US-6028058-A INHIBITING NUCLEAR LOCALIZATION OF HIGH MOLECULAR WEIGHT FORMS OF FGF-2, COMPRISING ADMINISTERING TO CELL EFFECTIVE AMOUNT OF POLYPEPTIDE CIBLEX CORPORATION (US) 2000-02-22 US disclosed
EP-0941733-A2 Methods of inhibiting leaderless protein export using cardiac glycosides and derivatives The Scripps Research Institute (US) 1999-09-15 EP disclosed
EP-0828497-B1 METHODS OF INHIBITING LEADERLESS PROTEIN EXPORT USING CARDIAC GLYCOSIDES OR AGLYCONES THEREFROM AND DERIVATIVES SCRIPPS RESEARCH INST (US) 1999-09-01 EP disclosed
WO-1999003489-A2 METHODS AND COMPOSITIONS FOR REGULATING NUCLEAR TRAFFICKING OF PROTEINS CIBLEX CORPORATION (US) 1999-01-28 WO disclosed
WO-1998037880-A1 INHIBITORS OF LEADERLESS PROTEIN EXPORT CIBLEX CORPORATION (US) 1998-09-03 WO disclosed
EP-0828497-A1 METHODS OF INHIBITING LEADERLESS PROTEIN EXPORT USING CARDIAC GLYCOSIDES OR AGLYCONES THEREFROM AND DERIVATIVES The Scripps Research Institute (US) 1998-03-18 EP disclosed
WO-1997028808-A1 METHODS OF INHIBITING LEADERLESS PROTEIN EXPORT USING CARDIAC GLYCOSIDES OR AGLYCONES THEREFROM AND DERIVATIVES THE SCRIPPS RESEARCH INSTITUTE (US) 1997-08-14 WO disclosed