SCHEMBL3141368

SCHEMBL3141368

COc1ccc2nc3c(OC)cccc3c(C(=O)O)c2c1-c1c(C)cc(C(=O)OCc2ccccc2)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 3/20 0.43
TOP2B Q02880 3/20 0.43
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
MRGPRX4 Q96LA9 2/20 0.39
PDE10A Q9Y233 1/20 0.39
DHODH Q02127 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39
MAPT P10636 1/20 0.38
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
PRKCZ Q05513 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36

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
SCHEMBL3047145 0.88 PLA2G2A (0.46) KMT2ADHODHKDM4EALDH1A1LMNA
SCHEMBL13223627 0.80 TOP2A (0.50) TOP2ATOP2BKMT2AMEN1POLB
SCHEMBL13223653 0.78 TOP2A (0.49) TOP2ATOP2BKMT2AMEN1POLB
SCHEMBL13985684 0.73 ALDH1A1 (0.39) KMT2AMEN1POLBDHODHKDM4E
SCHEMBL25682702 0.72 TDP1 (0.57) KMT2AALDH1A1LMNAMAPTSLC6A2
SCHEMBL13223633 0.71 TOP2A (0.43) TOP2ATOP2BKMT2AMEN1POLB
SCHEMBL13223651 0.71 PLA2G2A (0.45) TOP2ATOP2BKMT2ADHODHKDM4E
SCHEMBL6199393 0.70 MAPT (0.37) TOP2ATOP2BKMT2AMEN1PDE10A
SCHEMBL924517 0.69 PRNP (0.39) KMT2AMEN1POLBDHODHSLC6A2
SCHEMBL13223636 0.69 NPC1 (0.59) TOP2ATOP2BKMT2AMEN1PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1946108-B1 HIGH QUANTUM YIELD ACRIDINIUM COMPOUNDS AND THEIR USES IN IMPROVING ASSAY SENSITIVITY SIEMENS HEALTHCARE DIAGNOSTICS (US) 2014-10-01 EP disclosed
US-7785904-B2 High quantum yield acridinium compounds and their uses in improving assay sensitivity SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2010-08-31 US disclosed
EP-1946108-A2 HIGH QUANTUM YIELD ACRIDINIUM COMPOUNDS AND THEIR USES IN IMPROVING ASSAY SENSITIVITY Bayer Healthcare LLC (US) 2008-07-23 EP disclosed
US-20080014660-A1 High Quantum Yield Acridinium Compounds and Their Uses in Improving Assay Sensitivity BAYER HEALTHCARE LLC 2008-01-17 US disclosed
US-7309615-B2 High quantum yield acridinium compounds and their uses in improving assay sensitivity SIEMENS MEDICAL SOLUTIONS DIAGNOSTIC (US) 2007-12-18 US disclosed
WO-2006130736-A2 HIGH QUANTUM YIELD ACRIDINIUM COMPOUNDS AND THEIR USES IN IMPROVING ASSAY SENSITIVITY SIEMENS MEDICAL SOLUTIONS DIAGNOSTICS (US) 2006-12-07 WO disclosed
US-20050221390-A1 High quantum yield acridinium compounds and their uses in improving assay sensitivity BAYER HEALTHCARE LLC (US) 2005-10-06 US disclosed