SCHEMBL2825166

SCHEMBL2825166

O=[N+]([O-])c1ccc([N+](=O)[O-])c([N+](=O)[O-])c1-c1ccccc1-c1c([N+](=O)[O-])c([N+](=O)[O-])c([N+](=O)[O-])c([N+](=O)[O-])c1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 2/20 0.51
PTPRC P08575 1/20 0.51
MAPT P10636 2/20 0.47
POLB P06746 1/20 0.47
APEX1 P27695 1/20 0.47
CASP6 P55212 1/20 0.47
ALDH1A1 P00352 4/20 0.44
TDP1 Q9NUW8 2/20 0.44
TSHR P16473 3/20 0.43
GPR35 Q9HC97 1/20 0.43
RECQL P46063 1/20 0.42
KMT2A Q03164 1/20 0.42
MCL1 Q07820 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
CYP3A4 P08684 3/20 0.41
HSD17B10 Q99714 2/20 0.41
TP53 P04637 2/20 0.41
HIF1A Q16665 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41

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
SCHEMBL2832447 0.88 PTPRC (0.44) S100A4PTPRCMAPTPOLBAPEX1
SCHEMBL224588 0.84 S100A4 (0.46) S100A4PTPRCMAPTPOLBAPEX1
SCHEMBL11429514 0.83 PTPRC (0.49) S100A4PTPRCMAPTPOLBAPEX1
SCHEMBL2832435 0.82 TDP1 (0.59) S100A4PTPRCMAPTALDH1A1TDP1
SCHEMBL2983469 0.75 PTPRC (0.57) S100A4PTPRCMAPTPOLBAPEX1
SCHEMBL630898 0.75 ALDH1A1 (0.59) S100A4PTPRCMAPTPOLBAPEX1
SCHEMBL155146 0.75 ALDH1A1 (0.69) S100A4PTPRCMAPTPOLBAPEX1
SCHEMBL28089412 0.74 ALDH1A1 (0.67) S100A4PTPRCMAPTPOLBAPEX1
SCHEMBL3476440 0.74 MAPT (0.59) S100A4PTPRCMAPTPOLBAPEX1
SCHEMBL27987835 0.74 ALDH1A1 (0.67) S100A4PTPRCMAPTPOLBAPEX1

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
US-8226782-B2 Application of high temperature explosive to downhole use SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2012-07-24 US disclosed
EP-1946104-B1 METHODS FOR MEASURING PRESENCE OR ABSENCE OF ANALYTES. COMMW SCIENT IND RES ORG (AU) 2010-10-27 EP disclosed
WO-2010042258-A2 APPLICATION OF HIGH TEMPERATURE EXPLOSIVE TO DOWNHOLE USE SCHLUMBERGER CANADA LIMITED (CA) 2010-04-15 WO disclosed
US-20100006193-A1 APPLICATION OF HIGH TEMPERATURE EXPLOSIVE TO DOWNHOLE USE SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2010-01-14 US disclosed
US-20090317845-A1 Impulsive Noise Sensor COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2009-12-24 US disclosed
EP-1946104-A4 IMPULSIVE NOISE SENSOR COMMW SCIENT IND RES ORG (AU) 2009-03-18 EP disclosed
EP-1946104-A1 IMPULSIVE NOISE SENSOR Commonweatlh Scientific and Industrial Reseach Organisation (AU) 2008-07-23 EP disclosed
WO-2007035991-A1 IMPULSIVE NOISE SENSOR COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2007-04-05 WO disclosed
US-6989064-B2 A shaped charge of a PBX explosive having a thermally stable polymeric binder of hexafluoropropylene-tetrafluoro-ethylene-vinylidene fluoride terpolymer (THV-220G tm); pressed explosives for oil fields and wells; high density SCHLUMBERGER TECHNOLOGY CORP. (US) 2006-01-24 US disclosed
US-20040050466-A1 Hi-temp explosive binder SCHLUMBERGER TECHNOLOGY CORPORATION 2004-03-18 US disclosed
US-20020129940-A1 High temperature explosives for downhole well applications SCHLUMBERGER TECHNOLOGY CORPORATION 2002-09-19 US disclosed
US-5149911-A Flexible sheet explosive THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1992-09-22 US disclosed