SCHEMBL4264669

SCHEMBL4264669

O=C1c2ccc(-c3cccc4ccccc34)cc2C(=O)c2ccc(-c3cccc4ccccc34)cc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 1/20 0.57
EDNRA P25101 1/20 0.57
PTPN1 P18031 4/20 0.51
CA12 O43570 4/20 0.51
CA1 P00915 4/20 0.51
CA2 P00918 4/20 0.51
CA9 Q16790 4/20 0.51
PTPRC P08575 3/20 0.51
MCL1 Q07820 1/20 0.51
ACMSD Q8TDX5 1/20 0.51
DNMT1 P26358 2/20 0.50
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 1/20 0.47
APAF1 O14727 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
THRB P10828 1/20 0.47
XBP1 P17861 1/20 0.47

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
SCHEMBL1820911 1.00 EDNRB (0.57) EDNRBEDNRAPTPN1CA12CA1
SCHEMBL30819040 1.00 EDNRB (0.57) EDNRBEDNRAPTPN1CA12CA1
SCHEMBL21524609 0.98 EDNRB (0.56) EDNRBEDNRAPTPN1CA12CA1
SCHEMBL21880031 0.96 EDNRB (0.57) EDNRBEDNRAPTPN1CA12CA1
SCHEMBL22799463 0.96 EDNRB (0.57) EDNRBEDNRAPTPN1CA12CA1
SCHEMBL13045525 0.87 PABPC1 (0.50) EDNRBEDNRAPTPN1CA12CA1
SCHEMBL16852595 0.87 PTPRC (0.57) EDNRBEDNRAPTPN1CA12CA1
SCHEMBL12553058 0.86 PTPRC (0.67) PTPN1PTPRCDNMT1NPC1RAB9A
SCHEMBL28048862 0.86 PTPRC (0.49) EDNRBEDNRAPTPN1PTPRCMCL1
SCHEMBL10045891 0.83 EDNRB (0.52) EDNRBEDNRAPTPN1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102795983-B Anthraquinone derivative material and its preparation method and application Haiyangwang Lighting Technology Co., Ltd. (CN) 2016-01-20 CN disclosed
EP-1999226-B1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-08-12 EP disclosed
EP-1999226-B1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-08-12 EP disclosed
US-8999521-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-04-07 US disclosed
US-8999521-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-04-07 US disclosed
US-8999521-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-04-07 US disclosed
US-20090146139-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2009-06-11 US disclosed
US-20090146139-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2009-06-11 US disclosed
US-20090146139-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2009-06-11 US disclosed
EP-1999226-A1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2008-12-10 EP disclosed
WO-2007110129-A1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2007-10-04 WO disclosed
WO-2007110129-A1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2007-10-04 WO disclosed