SCHEMBL864532

SCHEMBL864532

CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)c1ccncc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.44
NR1H3 Q13133 1/20 0.44
CHRM5 P08912 1/20 0.41
CHKA P35790 1/20 0.41
NAAA Q02083 1/20 0.41
SLC6A2 P23975 2/20 0.41
MAPT P10636 2/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
DNM1 Q05193 2/20 0.38
CNR2 P34972 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
SCHEMBL1261662 1.00 NR1H2 (0.44) NR1H2NR1H3CHRM5CHKANAAA
SCHEMBL18590690 1.00 NR1H2 (0.44) NR1H2NR1H3CHRM5CHKANAAA
SCHEMBL25385537 1.00 NR1H2 (0.44) NR1H2NR1H3CHRM5CHKANAAA
SCHEMBL8011634 1.00 NR1H2 (0.44) NR1H2NR1H3CHRM5CHKANAAA
Hexane SCHEMBL28188429 0.98 NR1H2 (0.43) NR1H2NR1H3CHRM5CHKANAAA
SCHEMBL8590762 0.98 NR1H2 (0.46) NR1H2NR1H3CHRM5CHKANAAA
SCHEMBL811561 0.92 NR1H2 (0.50) NR1H2NR1H3CHRM5CHKASLC6A2
Hydrochloric Acid SCHEMBL10636513 0.90 NR1H2 (0.49) NR1H2NR1H3CHRM5CHKASLC6A2
SCHEMBL10340990 0.89 CYP3A4 (0.50) NR1H2NR1H3NAAAMAPTMAPK1
SCHEMBL21078065 0.88 NR1H2 (0.48) NR1H2NR1H3CHRM5CHKASLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3614468-B1 ELECTROCHEMICAL ENERGY STORAGE DEVICE COMPRISNG PRUSSIAN BLUE POSITIVE ELECTRODE MATERIAL, AND PREPARATION METHOD FOR THE MATERIAL CONTEMPORARY AMPEREX TECHNOLOGY CO LTD (CN) 2023-08-09 EP disclosed
EP-1873117-B1 METHODS FOR PRODUCING ULTRAFINE PARTICLE OF PRUSSIAN BLUE-TYPE METAL COMPLEX AND OF A DISPERSION LIQUID THEREOF AIST (JP) 2018-05-30 EP disclosed
EP-2116511-B1 METHOD OF REGULATING THE COLOR OF PRUSSIAN BLUE TYPE METAL COMPLEX NANOPARTICLES, PRUSSIAN BLUE TYPE METAL COMPLEX NANOPARTICLE OBTAINED BY THE SAME, DISPERSION OF THE NANOPARTICLES, ELECTRODE AND TRANSMITTED-LIGHT REGULATOR BOTH EMPLOYING THE NANOPARTICLES AIST (JP) 2018-04-18 EP disclosed
US-8658251-B2 Method of producing structural member having prussian blue-type metal complex nanoparticles, structural member obtained by the method, substrate, electrochromic device, rectifying device, and photo responding device, using the structural member NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2014-02-25 US disclosed
US-8349221-B2 Method of producing prussian blue-type metal complex nanoparticles, and prussian blue-type metal complex nanoparticles obtained by the method, dispersion of the nanoparticles, method of regulating the color of the nanoparticles, and electrode and transmitted light-regulator each using the nanoparticles NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2013-01-08 US disclosed
US-20120077037-A1 METAL COMPLEX NANOPARTICLES AND METHOD FOR PRODUCING THE SAME NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2012-03-29 US disclosed
US-20110268963-A1 METHOD OF PRODUCING STRUCTURAL MEMBER HAVING PRUSSIAN BLUE-TYPE METAL COMPLEX NANOPARTICLES, STRUCTURAL MEMBER OBTAINED BY THE METHOD, SUBSTRATE, ELECTROCHROMIC DEVICE, RECTIFYING DEVICE, AND PHOTO RESPONDING DEVICE, USING THE STRUCTURAL MEMBER National instutute of advanced industrial science and technology (JP) 2011-11-03 US disclosed
US-20100133487-A1 METHOD OF PRODUCING PRUSSIAN BLUE-TYPE METAL COMPLEX NANOPARTICLES, AND PRUSSIAN BLUE-TYPE METAL COMPLEX NANOPARTICLES OBTAINED BY THE METHOD, DISPERSION OF THE NANOPARTICLES, METHOD OF REGULATING THE COLOR OF THE NANOPARTICLES, AND ELECTRODE AND TRANSMITTED LIGHT-REGULATOR EACH USING THE NANOPARTICLES NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2010-06-03 US disclosed
US-7678188-B2 Ultrafine particles of Prussian blue-type metal complex, dispersion liquid thereof and their production methods NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2010-03-16 US disclosed
EP-2116511-A1 PROCESS FOR PRODUCING NANOPARTICLE OF PRUSSIAN BLUE TYPE METAL COMPLEX, PRUSSIAN BLUE TYPE METAL COMPLEX NANOPARTICLE OBTAINED BY THE SAME, DISPERSION OF THE NANOPARTICLES, METHOD OF REGULATING COLORATION OF THE NANOPARTICLES, AND ELECTRODE AND TRANSMITTED-LIGHT REGULATOR BOTH EMPLOYING THE NANOPARTICLES National Institute Of Advanced Industrial Science (JP) 2009-11-11 EP disclosed
US-20090211494-A1 ULTRAFINE PARTICLES OF PRUSSIAN BLUE-TYPE METAL COMPLEX, DISPERSION LIQUID THEREOF AND THEIR PRODUCTION METHODS NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2009-08-27 US disclosed
US-20080266643-A1 Electrode for Reversible Color Change Display Device and Method of Producing the Same, and Reversible Color Change Display Device and Reversible Color Change Lighting Control Device NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2008-10-30 US disclosed
EP-1873117-A1 ULTRAFINE PARTICLE OF PRUSSIAN BLUE-TYPE METAL COMPLEX, DISPERSION LIQUID THEREOF, AND THEIR PRODUCTION METHODS National Institute of Advanced Industrial Science and Technology (JP) 2008-01-02 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090211494-A1 ULTRAFINE PARTICLES OF PRUSSIAN BLUE-TYPE METAL COMPLEX, DISPERSION LIQUID THEREOF AND THEIR PRODUCTION METHODS MB, F2, PRNP NR1H2 3862/4885NR1H3 3614/4885CHRM5 238/4885
US-20100133487-A1 METHOD OF PRODUCING PRUSSIAN BLUE-TYPE METAL COMPLEX NANOPARTICLES, AND PRUSSIAN BLUE-TYPE METAL COMPLEX NANOPARTICLES OBTAINED BY THE METHOD, DISPERSION OF THE NANOPARTICLES, METHOD OF REGULATING THE COLOR OF THE NANOPARTICLES, AND ELECTRODE AND TRANSMITTED LIGHT-REGULATOR EACH USING THE NANOPARTICLES MB, CYBA, CD79B NR1H2 3645/4885NR1H3 3836/4885CHRM5 1281/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.