SCHEMBL861962

SCHEMBL861962

Nc1ccc(NN2CCNCCNCCNCC2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 3/20 0.39
CCNC P24863 1/20 0.34
CDK8 P49336 1/20 0.34
MAPT P10636 4/20 0.33
ALDH1A1 P00352 2/20 0.33
HTT P42858 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
ALOX12 P18054 1/20 0.33
CYP2C19 P33261 1/20 0.33
HTR6 P50406 4/20 0.33
RAB9A P51151 2/20 0.32
HTR1D P28221 1/20 0.32
HTR2C P28335 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
RAD52 P43351 1/20 0.31
HTR3E A5X5Y0 1/20 0.31
HTR3B O95264 1/20 0.31

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
SCHEMBL644787 0.78 POLB (0.49) ALDH1A1CYP1A2HTR6HTR3EHTR3B
SCHEMBL30631698 0.75 ALDH1A1 (0.58) MAPTALDH1A1HTTMEN1KMT2A
SCHEMBL2234081 0.74 ADRA2C (0.52) MAPTALDH1A1HTTL3MBTL1CYP1A2
SCHEMBL4147985 0.74 ADRB1 (0.32) HTR3EHTR3BADRB1HTR3AHTR3D
SCHEMBL5536482 0.74 CTSS (0.44) MAPTALDH1A1HTR1DHTR2CHTR3E
SCHEMBL6626303 0.72 POLB (0.44) ALDH1A1CYP3A4CYP2C19HTR6HRH3
SCHEMBL6151619 0.69 ADRB1 (0.61) MAPTALDH1A1HTTL3MBTL1HTR6
SCHEMBL12832086 0.69 ADRB1 (0.61) MAPTALDH1A1HTTL3MBTL1HTR6
Piperazine SCHEMBL28708983 0.69 ADRB1 (0.61) MAPTALDH1A1HTTL3MBTL1HTR6
SCHEMBL6782990 0.67 KDM4E (0.41) MAPTALDH1A1HTTCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6911457-B2 Imaging probes and methods for using the probes in diagnostic imaging processes and other imaging processes to determine physiological functions. CARBOMER, INC. (US) 2005-06-28 US claimed
US-20030207823-A1 Novel diabetes imaging probes CARBOMER, INC. 2003-11-06 US claimed
US-12486302-B2 Somatostatin receptor antagonist compounds and methods of using the same CDRD VENTURES INC. (CA) 2025-12-02 US disclosed
US-20220112242-A1 SOMATOSTATIN RECEPTOR ANTAGONIST COMPOUNDS AND METHODS OF USING THE SAME CDRD VENTURES INC. (CA) 2022-04-14 US disclosed
EP-2433963-A1 Receptor (SSTR2)-selective somatostatin antagonists The Salk Institute for Biological Studies (US) 2012-03-28 EP disclosed
US-20110269683-A1 RECEPTOR(SSTR2)-SELECTIVE SOMATOSTATIN ANTAGONISTS UNIVERSITY HOSPITAL BASEL 2011-11-03 US disclosed
EP-2383289-A1 Receptor (SSTR2)-selective somatostatin antagonists The Salk Institute for Biological Studies (US) 2011-11-02 EP disclosed
US-7960342-B2 Side effect reduction; block receptor function so they can be used in therapy; labeled with radioactive iodine; drug screening THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2011-06-14 US disclosed
US-7192570-B2 Compositions of somatostatin analogues UNIVERSITY OF BERN (CH) 2007-03-20 US disclosed
EP-1419178-B1 SOMATOSTATIN ANALOGUES AND THEIR USE SOMATOSTATIN ANALOGUES BINDING TO ALL SOMATOSTATIN RECEPTOR AND THEIR USE UNIV BERN (CH) 2006-05-31 EP disclosed
US-7048907-B2 Synthesis, compositions and methods for the measurement of the concentration of stable-isotope labeled compounds in life forms and life form excretory products BIOPHYSICS ASSAY LABORATORY, INC. (US) 2006-05-23 US disclosed
US-20060067881-A1 Synthesis, compositions and methods for the measurement of the concentration of stable-isotope labeled compounds in life forms and life form excretory products BIOPHYSICS ASSAY LABORATORY, INC. 2006-03-30 US disclosed
US-6911457-B2 Imaging probes and methods for using the probes in diagnostic imaging processes and other imaging processes to determine physiological functions. CARBOMER, INC. (US) 2005-06-28 US disclosed
US-20040242842-A1 Somatostatin analogues and their use somatostatin analogues binding to all somatostatin receptor and their use UNIVERSITY OF BERN (CH) 2004-12-02 US disclosed
US-20030207823-A1 Novel diabetes imaging probes CARBOMER, INC. 2003-11-06 US disclosed
US-20030059368-A1 Synthesis, compositions and methods for the measurement of the concentration of stable-isotope labeled compounds in life forms and life form excretory products BIOPAL, INC. 2003-03-27 US disclosed
EP-1283216-A1 Somatostatin analogues binding to all somatostatin receptor subtypes and their use Mallinckrodt Inc. (US) 2003-02-12 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 (6 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-12486302-B2 Somatostatin receptor antagonist compounds and methods of using the same GPR119, SSTR5, SSTR2 PLK4 3811/4885CCNC 3026/4885CDK8 1965/4885
US-20220112242-A1 SOMATOSTATIN RECEPTOR ANTAGONIST COMPOUNDS AND METHODS OF USING THE SAME GPR119, SSTR5, SSTR2 PLK4 3811/4885CCNC 3026/4885CDK8 1965/4885
US-20040242842-A1 Somatostatin analogues and their use somatostatin analogues binding to all somatostatin receptor and their use SSTR5, NPY5R, GLP1R PLK4 3279/4885CCNC 4003/4885CDK8 3525/4885
US-20110269683-A1 RECEPTOR(SSTR2)-SELECTIVE SOMATOSTATIN ANTAGONISTS SSTR5, SSTR4, SSTR3 PLK4 3598/4885CCNC 4255/4885CDK8 3572/4885
US-20030207823-A1 Novel diabetes imaging probes IAPP, GPR119, DPP4 PLK4 4191/4885CCNC 4625/4885CDK8 4609/4885
US-20060067881-A1 Synthesis, compositions and methods for the measurement of the concentration of stable-isotope labeled compounds in life forms and life form excretory products ATP6V1B1, REN, GLS PLK4 3732/4885CCNC 1526/4885CDK8 1718/4885

“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.