SCHEMBL8765283

SCHEMBL8765283

COc1ccc(-c2cc(-c3cccc(CN(CC(=O)O)CC(=O)O)n3)nc(-c3cccc(CN(CC(=O)O)CC(=O)O)n3)c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.45
LTB4R Q15722 3/20 0.44
ADORA3 P0DMS8 2/20 0.42
HPGD P15428 3/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
GYS1 P13807 1/20 0.39
ALPL P05186 1/20 0.39
CA9 Q16790 1/20 0.39
CHEK1 O14757 1/20 0.39
MEP1A Q16819 1/20 0.39
MEP1B Q16820 1/20 0.39
ERCC5 P28715 1/20 0.39
FEN1 P39748 1/20 0.39
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38
MAPK1 P28482 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
SCHEMBL13217240 0.97 MCL1 (0.42) MCL1LTB4RADORA3HPGDKDM4E
SCHEMBL8596932 0.95 MCL1 (0.41) MCL1LTB4RADORA3HPGDKDM4E
SCHEMBL8597039 0.93 MEN1 (0.44) MCL1LTB4RADORA3KDM4ENPC1
SCHEMBL8633585 0.91 HPGD (0.41) MCL1LTB4RADORA3HPGDKDM4E
SCHEMBL8935826 0.90 ADORA3 (0.46) LTB4RADORA3KDM4EALDH1A1MAPK1
SCHEMBL13997749 0.88 LTB4R (0.39) MCL1LTB4RADORA3KDM4EALDH1A1
SCHEMBL8935762 0.87 KMT2A (0.43) MCL1ADORA3HPGDKDM4EALDH1A1
SCHEMBL8601997 0.86 ALDH1A1 (0.44) ADORA3HPGDKDM4EALDH1A1SMN1; SMN2
SCHEMBL13997750 0.84 LTB4R (0.41) LTB4RHPGDKDM4EALDH1A1LMNA
SCHEMBL9594349 0.84 LTB4R (0.41) LTB4RHPGDKDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0664819-B1 CHELATING POLYMERS NYCOMED IMAGING AS (NO) 1997-08-06 EP claimed
US-9505961-B2 Acrylic pressure sensitive adhesive composition, protection film including the same, polarizer and liquid crystal display LG CHEM, LTD. (KR) 2016-11-29 US disclosed
US-9499725-B2 Acrylic pressure-sensitive adhesive compositions LG CHEM, LTD. (KR) 2016-11-22 US disclosed
US-9499725-B2 Acrylic pressure-sensitive adhesive compositions LG CHEM, LTD. (KR) 2016-11-22 US disclosed
US-7863360-B2 Acrylic pressure sensitive adhesive compositions LG CHEM, LTD. (KR) 2011-01-04 US disclosed
US-7863360-B2 Acrylic pressure sensitive adhesive compositions LG CHEM, LTD. (KR) 2011-01-04 US disclosed
US-20100209631-A1 ACRYLIC PRESSURE SENSITIVE ADHESIVE COMPOSITION, PROTECTION FILM INCLUDING THE SAME, POLARIZER AND LIQUID CRYSTAL DISPLAY LG CHEM, LTD. (KR) 2010-08-19 US disclosed
US-20100188620-A1 ACRYLIC PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS LG CHEM, LTD. (KR) 2010-07-29 US disclosed
US-20100188620-A1 ACRYLIC PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS LG CHEM, LTD. (KR) 2010-07-29 US disclosed
US-5539117-A 2-acetyl-6-cyanopyridines and their use as intermediates in the synthesis of oligo-2,6-pyridines GE HEALTHCARE AS (NO) 1996-07-23 US disclosed
US-5350696-A 2-acetyl-6-cyanopyridines and their use as intermediates in the synthesis of oligo-2,6-pyridines STERLING WINTHROP, INC. (US) 1994-09-27 US disclosed