SCHEMBL886901

SCHEMBL886901

Nc1ccc(/N=N/c2ccc([As](=O)(O)O)cc2)cc1.[NaH]

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.76
RAB9A P51151 4/20 0.72
KDM4E B2RXH2 3/20 0.72
TSHR P16473 2/20 0.72
MAPT P10636 7/20 0.66
KMT2A Q03164 6/20 0.56
MEN1 O00255 5/20 0.56
TDP1 Q9NUW8 3/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
NPC1 O15118 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
CYP2D6 P10635 1/20 0.50
TP53 P04637 2/20 0.48
PKM P14618 1/20 0.48
HTT P42858 1/20 0.48
ALDH1A1 P00352 4/20 0.46
POLB P06746 3/20 0.46
CA9 Q16790 3/20 0.46
CA12 O43570 2/20 0.46
CA2 P00918 2/20 0.46

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
SCHEMBL886903 1.00 CYP2C19 (0.76) CYP2C19RAB9AKDM4ETSHRMAPT
SCHEMBL1527750 0.98 CYP2C19 (0.79) CYP2C19RAB9AKDM4ETSHRMAPT
SCHEMBL3406380 0.98 CYP2C19 (0.79) CYP2C19RAB9AKDM4ETSHRMAPT
Arsanilic Acid SCHEMBL5051668 0.87 KDM4E (0.95) CYP2C19RAB9AKDM4ETSHRMAPT
SCHEMBL1133551 0.87 CYP2C19 (1.00) CYP2C19RAB9AKDM4ETSHRMAPT
SCHEMBL31707405 0.87 CYP2C19 (1.00) CYP2C19RAB9AKDM4ETSHRMAPT
Arsanilic Acid SCHEMBL4837583 0.85 KDM4E (1.00) CYP2C19RAB9AKDM4ETSHRMAPT
Arsanilic Acid SCHEMBL160507 0.85 KDM4E (1.00) CYP2C19RAB9AKDM4ETSHRMAPT
Arsanilic Acid SCHEMBL31473003 0.83 TSHR (0.95) CYP2C19RAB9AKDM4ETSHRMAPT
SCHEMBL886902 0.81 CYP2C19 (0.53) CYP2C19RAB9AKDM4ETSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130196057-A1 METHOD FOR PREPARING A SURFACE ENHANCED RAMAN SPECTROSCOPY PARTICLE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2013-08-01 US claimed
US-20110070662-A1 RAMAN-ACTIVE REAGENTS AND THE USE THEREOF IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2011-03-24 US claimed
US-20110070661-A1 RAMAN-ACTIVE REAGENTS AND THE USE THEREOF IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2011-03-24 US claimed
EP-2255175-A1 MULTIPLEXED ANALYSIS METHODS USING SERS-ACTIVE NANOPARTICLES Morpho Detection, Inc. (US) 2010-12-01 EP claimed
US-7829348-B2 Raman-active reagents and the use thereof IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2010-11-09 US claimed
US-20100279272-A1 MULTIPLEXED ANALYSIS METHODS USING SERS-ACTIVE NANOPARTICLES GE HOMELAND PROTECTION, INC. 2010-11-04 US claimed
US-7824926-B1 Raman-active reagents and the use thereof IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2010-11-02 US claimed
WO-2009102598-A1 MULTIPLEXED ANALYSIS METHODS USING SERS-ACTIVE NANOPARTICLES GENERAL ELECTRIC COMPANY (US) 2009-08-20 WO claimed
US-20050089901-A1 Raman-active reagents and the use thereof NI, JING 2005-04-28 US claimed
US-10968474-B2 Devices for detecting target biological molecules from cells and viruses UNIVERSITY OF FLORIDA RESEARCH FOUNDATION INC. (US) 2021-04-06 US disclosed
US-20190323069-A1 DEVICES FOR DETECTING TARGET BIOLOGICAL MOLECULES FROM CELLS AND VIRUSES UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2019-10-24 US disclosed
US-10301667-B2 Devices for detecting target biological molecules from cells and viruses UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2019-05-28 US disclosed
US-10088478-B2 Fluorescence enhancing plasmonic nanoscopic gold films and assays based thereon THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2018-10-02 US disclosed
US-9823246-B2 Fluorescence enhancing plasmonic nanoscopic gold films and assays based thereon THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2017-11-21 US disclosed
US-20030211488-A1 Nanoparticle probs with Raman spectrocopic fingerprints for analyte detection NORTHWESTERN UNIVERSITY (US) 2003-11-13 US disclosed
EP-0587008-B1 Surface-enhanced raman spectroscopy immunoassy ABBOTT LAB (US) 1999-02-10 EP disclosed
US-5567628-A Surface-enhanced raman spectroscopy immunoassay method, composition and kit ABBOTT LABORATORIES (US) 1996-10-22 US disclosed
US-5445972-A Raman label and its conjugate in a ligand-binding assay for a test sample analyte ABBOTT LABORATORIES (US) 1995-08-29 US disclosed
US-5376556-A Surface-enhanced Raman spectroscopy immunoassay ABBOTT LABORATORIES (US) 1994-12-27 US disclosed
US-5266498-A Ligand binding assay for an analyte using surface-enhanced scattering (SERS) signal ABBOTT LABORATORIES (US) 1993-11-30 US disclosed