SCHEMBL3700633

SCHEMBL3700633

Nc1ccc(-c2c([N+](=O)[O-])c([N+](=O)[O-])c(N)c([N+](=O)[O-])c2[N+](=O)[O-])cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.48
MAPT P10636 5/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
TDP1 Q9NUW8 5/20 0.39
CYP3A4 P08684 3/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 3/20 0.38
ALOX15 P16050 2/20 0.38
POLB P06746 2/20 0.38
CA9 Q16790 3/20 0.36
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA14 Q9ULX7 1/20 0.36
RECQL P46063 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 2/20 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
SCHEMBL10401073 0.78 ALDH1A1 (0.39) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL29232798 0.75 ALDH1A1 (0.40) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL4462059 0.73 HPRT1 (0.46) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL7861184 0.72 ALDH1A1 (0.39) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL9650808 0.70 ALDH1A1 (0.86) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL595873 0.70 ALDH1A1 (0.86) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL438677 0.69 ALDH1A1 (0.40) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL28259059 0.69 ALDH1A1 (0.60) ALDH1A1MAPTMEN1KMT2ACYP3A4
SCHEMBL153658 0.69 ALDH1A1 (0.50) ALDH1A1MAPTMEN1KMT2ATDP1
Benzidine SCHEMBL27858206 0.69 TDP1 (0.58) ALDH1A1MAPTMEN1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150079587-A1 METHOD FOR DETECTING NUCLEIC ACIDS BY SIMULTANEOUS ISOTHERMAL AMPLIFICATION OF NUCLEIC ACIDS AND SIGNAL PROBE GREEN CROSS MEDICAL SCIENCE CORP. (KR) 2015-03-19 US disclosed
CN-1798976-B Method of diagnosis of foot and mouth disease and the diagnostic kit REP KOREA NAT VET & QUARANTINE 2011-03-23 CN disclosed
US-20100311058-A1 METHOD FOR DETECTING NUCLEIC ACIDS BY SIMULTANEOUS ISOTHERMAL AMPLIFICATION OF NUCLEIC ACIDS AND SIGNAL PROBE RAPLEGENE INC. (KR) 2010-12-09 US disclosed
WO-2009072705-A1 METHOD FOR DETECTING NUCLEIC ACIDS BY SIMULTANEOUS ISOTHERMAL AMPLIFICATION OF NUCLEIC ACIDS AND SIGNAL PROBE RAPLEGENE INC. (KR) 2009-06-11 WO disclosed
US-20090130677-A1 METHOD FOR ISOTHERMAL AMPLIFICATION OF NUCLEIC ACIDS AND METHOD FOR DETECTING NUCLEIC ACIDS USING SIMULTANEOUS ISOTHERMAL AMPLIFICATION OF NUCLEIC ACIDS AND SIGNAL PROBE GREEN CROSS MEDICAL SCIENCE CORP. (KR) 2009-05-21 US disclosed
US-20070128587-A1 Method of diagnosis of foot and mouth disease and the diagnostic kit Republic of Korea ( National Veterinary Research and Quarantine Service) (KR) 2007-06-07 US disclosed
WO-2007043751-A1 METHOD FOR ISOTHERMAL AMPLIFICATION OF NUCLEIC ACIDS AND METHOD FOR DETECTING NUCLEIC ACIDS USING SIMULTANEOUS ISOTHERMAL AMPLIFICATION OF NUCLEIC ACIDS AND SIGNAL PROBE RAPLEGENE INC. (KR) 2007-04-19 WO disclosed
EP-1618381-A4 METHOD OF DIAGNOSIS OF FOOT AND MOUTH DISEASE AND THE DIAGNOSTIC KIT REP KOREA NAT VET & QUARANTINE (KR) 2007-02-21 EP disclosed
CN-1798976-A Method of diagnosis of foot and mouth disease and the diagnostic kit REP KOREA NAT VET & QUARANTINE (KR) 2006-07-05 CN disclosed
EP-1618381-A1 METHOD OF DIAGNOSIS OF FOOT AND MOUTH DISEASE AND THE DIAGNOSTIC KIT Republic of Korea (National Veterinary Research and Quarantine Service) (KR) 2006-01-25 EP disclosed
WO-2004097418-A1 METHOD OF DIAGNOSIS OF FOOT AND MOUTH DISEASE AND THE DIAGNOSTIC KIT REPUBLIC OF KOREA (NATIONAL VETERINARY RESEARCH AND QUARANTINE SERVICE) (KR) 2004-11-11 WO disclosed
WO-2003105899-A1 APPARATUS AND METHODS FOR DETECTING CEREBROSPINAL FLUID NEUROPRO TECHNOLOGIES, INC. (US) 2003-12-24 WO disclosed
US-20020177240-A1 IMMUNOASSAY FOR DETECTION OF VERY LOW DENSITY LIPOPROTEIN AND ANTIBODIES USEFUL THEREFOR ABBOTT LABORATORIES 2002-11-28 US disclosed
US-4935544-A Polynitrobiphenyl derivative THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1990-06-19 US disclosed
US-4935544-A Polynitrobiphenyl derivative THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1990-06-19 US disclosed