SCHEMBL3047145

SCHEMBL3047145

COc1ccc2nc3ccc(OC)c(-c4c(C)cc(C(=O)OCc5ccccc5)cc4C)c3c(C(=O)O)c2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 2/20 0.46
DHODH Q02127 3/20 0.44
PRNP P04156 1/20 0.41
TACR3 P29371 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
ACHE P22303 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
HRAS P01112 1/20 0.38
CASP3 P42574 1/20 0.38
KMT2A Q03164 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
SHMT2 P34897 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL3141368 0.88 TOP2A (0.43) DHODHTDP1KMT2AKDM4EALDH1A1
SCHEMBL924047 0.80 PLA2G2A (0.51) PLA2G2ADHODHTACR3TDP1CASP3
SCHEMBL3034156 0.78 PLA2G2A (0.48) PLA2G2ADHODHTACR3TDP1CASP3
SCHEMBL7531961 0.78 PLA2G2A (0.48) PLA2G2ADHODHTACR3TDP1CASP3
SCHEMBL924517 0.78 PRNP (0.39) PLA2G2ADHODHPRNPCA1CA2
SCHEMBL4802002 0.77 PLA2G2A (0.48) PLA2G2ADHODHACHETDP1KMT2A
SCHEMBL13223653 0.76 TOP2A (0.49) PLA2G2ADHODHPRNPTDP1KMT2A
SCHEMBL13223651 0.76 PLA2G2A (0.45) PLA2G2ADHODHPRNPTACR3TDP1
SCHEMBL13985684 0.73 ALDH1A1 (0.39) DHODHTDP1KMT2AKDM4EALDH1A1
SCHEMBL923917 0.73 MMP13 (0.55) PLA2G2AACHECASP3KMT2ASENP8

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