SCHEMBL985995

SCHEMBL985995

O=[N+]([O-])c1cnc(Cl)c([N+](=O)[O-])c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.51
ALDH1A1 P00352 8/20 0.50
MAPK1 P28482 3/20 0.50
HTT P42858 1/20 0.50
GPR35 Q9HC97 3/20 0.47
TDP1 Q9NUW8 3/20 0.43
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 2/20 0.41
HIF1A Q16665 2/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TTR P02766 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 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
SCHEMBL29780392 1.00 AHR (0.51) AHRALDH1A1MAPK1HTTGPR35
Hydrochloric Acid SCHEMBL14989233 0.98 AHR (0.50) AHRALDH1A1MAPK1HTTGPR35
Hydrochloric Acid SCHEMBL14989234 0.98 AHR (0.50) AHRALDH1A1MAPK1HTTGPR35
SCHEMBL26633207 0.82 TSHR (0.37) AHRALDH1A1MAPK1HTTGPR35
SCHEMBL29438693 0.82 ALDH1A1 (0.54) AHRALDH1A1MAPK1HTTGPR35
SCHEMBL364459 0.82 ALDH1A1 (0.54) AHRALDH1A1MAPK1HTTGPR35
SCHEMBL29445407 0.82 MAPK1 (0.44) AHRALDH1A1MAPK1GPR35TSHR
SCHEMBL113455 0.82 MAPK1 (0.44) AHRALDH1A1MAPK1GPR35TSHR
SCHEMBL8078061 0.79 ALDH1A1 (0.53) AHRALDH1A1MAPK1HTTGPR35
SCHEMBL31143401 0.78 ALDH1A1 (0.47) AHRALDH1A1HTTGPR35TDP1

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 471 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962826-B2 Method for producing amide compound UBE INDUSTRIES, LTD. (JP) 2015-02-24 US claimed
EP-2123635-B1 METHOD FOR PRODUCTION OF LAUROLACTAM UNIV NAGOYA NAT UNIV CORP (JP) 2013-06-05 EP claimed
US-8309714-B2 Process for producing laurolactam UBE INDUSTRIES, LTD. (JP) 2012-11-13 US claimed
US-8163899-B2 Process for producing laurolactam NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2012-04-24 US claimed
US-7919755-B2 Dendrimer based electro-optic sensor APPLIED RESEARCH AND PHOTONICS, INC. 2011-04-05 US claimed
US-20100324283-A1 PROCESS FOR PRODUCING LAUROLACTAM NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2010-12-23 US claimed
US-7854505-B2 Passive and active photonic crystal structures and devices THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2010-12-21 US claimed
US-20100267944-A1 PROCESS FOR PRODUCING LAUROLACTAM UBE INDUSTRIES, LTD. (JP) 2010-10-21 US claimed
EP-2223911-A1 METHOD FOR PRODUCTION OF LAUROLACTAM Ube Industries, Ltd. (JP) 2010-09-01 EP claimed
US-20090323014-A1 PASSIVE AND ACTIVE PHOTONIC CRYSTAL STRUCTURES AND DEVICES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2009-12-31 US claimed
US-20080099698-A1 Dendrimer Based Terahertz Generator APPLIED RESEARCH AND PHOTONICS, INC. 2008-05-01 US claimed
US-5939568-A Accelerated catalysis of olefinic epoxidations THE SCRIPPS RESEARCH INSTITUTE (US) 1999-08-17 US claimed
WO-1998033786-A1 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS THE SCRIPPS RESEARCH INSTITUTE (US) 1998-08-06 WO claimed
EP-0491688-B1 METHODS FOR ACTIVATING POLYMERIC CARRIERS AND COMPOSITIONS PREPARED THEREFROM FOR USE IN AFFINITY CHROMATOGRAPHY BIOPROBE INT INC (US) 1996-01-31 EP claimed
US-5276132-A Polyamic acid or polyimide having a steroidal skeleton providing a pretilt angle of 3 to 90 degrees; SBE(super twisted birefringence effect) and SH(super homeotropic) devices JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1994-01-04 US claimed
EP-0491688-A4 METHODS FOR ACTIVATING POLYMERIC CARRIERS AND COMPOSITIONS PREPARED THEREFROM FOR USE IN AFFINITY CHROMATOGRAPHY 1993-03-10 EP claimed
EP-0491688-A1 METHODS FOR ACTIVATING POLYMERIC CARRIERS AND COMPOSITIONS PREPARED THEREFROM FOR USE IN AFFINITY CHROMATOGRAPHY. BIOPROBE INT INC (US) 1992-07-01 EP claimed
WO-1991003257-A1 METHODS FOR ACTIVATING POLYMERIC CARRIERS AND COMPOSITIONS PREPARED THEREFROM FOR USE IN AFFINITY CHROMATOGRAPHY BIOPROBE INTERNATIONAL, INC. (US) 1991-03-21 WO claimed
US-4981961-A Chemically-stable chromatography adsorber; modifying nucleophilic polymers with pyridine bases BIOPROBE INTERNATIONAL, INC. (US) 1991-01-01 US claimed
US-4119460-A FUSED CARBOCYCLIC RING COMPOUNDS, POLYPHENYL COMPOUNDS NITROGEN-FREE POLYARYLATED COMPOUNDS EASTMAN KODAK COMPANY (US) 1978-10-10 US claimed