SCHEMBL1361442

SCHEMBL1361442

N#CNCc1c(Cl)cccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.41
HTT P42858 4/20 0.41
NPSR1 Q6W5P4 2/20 0.41
GLA P06280 1/20 0.41
AKR1B1 P15121 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 2/20 0.37
POLB P06746 1/20 0.37
GAA P10253 2/20 0.36
PLA2G1B P04054 1/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36
PSMB8 P28062 2/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2A6 P11509 1/20 0.35

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
SCHEMBL5546533 0.77 AKR1B1 (0.43) TAAR1HTTNPSR1GLAAKR1B1
SCHEMBL28696675 0.74 HTT (0.39) TAAR1HTTNPSR1GLAAKR1B1
SCHEMBL11550107 0.74 KDM4E (0.46) TAAR1HTTNPSR1GLAAKR1B1
SCHEMBL2570362 0.73 TAAR1 (0.46) TAAR1HTTNPSR1GLAAKR1B1
Hydrochloric Acid SCHEMBL1421227 0.71 HTT (0.48) TAAR1HTTNPSR1GLAAKR1B1
SCHEMBL779716 0.71 TAAR1 (0.44) TAAR1HTTNPSR1GLAAKR1B1
SCHEMBL8985165 0.70 KMT2A (0.46) ALDH1A1KDM4EMAPTKMT2AATM
SCHEMBL8217518 0.69 TAAR1 (0.52) TAAR1HTTNPSR1GLAAKR1B1
SCHEMBL5546538 0.68 ADH1B (0.50) TAAR1HTTNPSR1GLAAKR1B1
SCHEMBL1720842 0.68 TAAR1 (0.52) TAAR1HTTNPSR1GLAAKR1B1

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
US-8067614-B2 N-substituted (benzoimidazol-2-yl)phenylamines, processes for their preparation, their use as a medicament or diagnostic aid, and a medicament comprising them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-11-29 US disclosed
US-20100168196-A1 N-Substituted (Benzoimidazol-2-yl)phenylamines, Processes for Their Preparation, Their Use as a Medicament or Diagnostic Aid, and a Medicament Comprising Them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-07-01 US disclosed
EP-1857445-B1 Substituted 2 amino imidazoles, method for their manufacture and their use as a drug or diagnostic and drug containing them SANOFI AVENTIS DEUTSCHLAND (DE) 2009-07-15 EP disclosed
US-20080275098-A1 Inhibit sodium proton exchangers; central nervous system, respiratory system, cardiovascular, urogenital, pyschological, biliary function and kidney disorders; sleep apnea, strokes; ketalization, acetalization, cyclization; similar to clonidine; hypotensive, antidiabetic, and antiischemic agents SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-11-06 US disclosed
US-7442717-B2 Substituted 2-aminoimidazoles, process for their preparation, their use as medicament or diagnostic aid SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-10-28 US disclosed
US-20080167359-A1 N-Substituted (Benzoimidazol-2-yl)phenylamines, Processes for Their Preparation, Their Use as a Medicament or Diagnostic Aid, and a Medicament Comprising Them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-07-10 US disclosed
EP-1592671-B1 N-SUBSTITUTED (BENZOIMIDAZOLE-2-YL) PHENYL AMINES, METHOD FOR THEIR PRODUCTION, THEIR USE AS A MEDICAMENT OR DIAGNOSTIC AGENT AND MEDICAMENT CONTAINING SAID SUBSTANCES SANOFI AVENTIS DEUTSCHLAND (DE) 2008-04-09 EP disclosed
EP-1857445-A2 Substituted 2 amino imidazoles, method for their manufacture and their use as a drug or diagnostic and drug containing them Sanofi-Aventis Deutschland GmbH (DE) 2007-11-21 EP disclosed
EP-1592669-B1 SUBSTITUTED 2-AMINOIMIDAZOLES, METHOD FOR THE PRODUCTION THEREOF, THEIR USE AS A MEDICAMENT OR AS A DIAGNOSTIC REAGENT, AND MEDICAMENT CONTAINING THESE COMPOUNDS SANOFI AVENTIS DEUTSCHLAND (DE) 2007-10-17 EP disclosed
EP-1592669-A2 NOVEL SUBSTITUTED 2-AMINOIMIDAZOLES, METHOD FOR THE PRODUCTION THEREOF, THEIR USE AS A MEDICAMENT OR AS A DIAGNOSTIC REAGENT, AND MEDICAMENT CONTAINING THESE COMPOUNDS Sanofi-Aventis Deutschland GmbH (DE) 2005-11-09 EP disclosed
US-20050054705-A1 N-substituted (benzoimidazol-2-yl) phenylamines, process for their preparation, their use as medicament or diagnostic aid, and medicament comprising them AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-03-10 US disclosed
US-20040259927-A1 Novel substituted 2-aminoimidazoles, process for their preparation, their use as medicament or diagnostic aid AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-12-23 US disclosed
WO-2004069806-A2 SUBSTITUTED 2-AMINOIMIDAZOLES, METHOD FOR THE PRODUCTION THEREOF, THEIR USE AS A MEDICAMENT OR AS A DIAGNOSTIC REAGENT, AND MEDICAMENT CONTAINING THESE COMPOUNDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-08-19 WO 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 (5 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-20040259927-A1 Novel substituted 2-aminoimidazoles, process for their preparation, their use as medicament or diagnostic aid NDUFAB1, ABAT, NDUFAF1 TAAR1 3122/4885HTT 3983/4885NPSR1 2540/4885
US-20080167359-A1 N-Substituted (Benzoimidazol-2-yl)phenylamines, Processes for Their Preparation, Their Use as a Medicament or Diagnostic Aid, and a Medicament Comprising Them SLC10A1, SLC9A3, ABCB11 TAAR1 2513/4885HTT 920/4885NPSR1 516/4885
US-20080275098-A1 Inhibit sodium proton exchangers; central nervous system, respiratory system, cardiovascular, urogenital, pyschological, biliary function and kidney disorders; sleep apnea, strokes; ketalization, acetalization, cyclization; similar to clonidine; hypotensive, antidiabetic, and antiischemic agents ATP6V1B1, SLC10A1, GLS TAAR1 1104/4885HTT 1684/4885NPSR1 403/4885
US-20100168196-A1 N-Substituted (Benzoimidazol-2-yl)phenylamines, Processes for Their Preparation, Their Use as a Medicament or Diagnostic Aid, and a Medicament Comprising Them SLC10A1, SLC9A3, ABCB11 TAAR1 2513/4885HTT 920/4885NPSR1 516/4885
US-20050054705-A1 N-substituted (benzoimidazol-2-yl) phenylamines, process for their preparation, their use as medicament or diagnostic aid, and medicament comprising them SLC10A1, SLC9A3, NHERF1 TAAR1 2618/4885HTT 1098/4885NPSR1 523/4885

“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.