SCHEMBL1170567

SCHEMBL1170567

CCN(CC)c1ccc(-c2nc(-c3c[nH]c4ccccc34)[nH]c2-c2ccc(N(CC)CC)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NT5E P21589 1/20 0.70
NOX1 Q9Y5S8 1/20 0.47
PDGFRB P09619 3/20 0.44
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
MAPT P10636 6/20 0.41
HPGD P15428 3/20 0.41
MAPK14 Q16539 3/20 0.41
LMNA P02545 2/20 0.41
MAPK13 O15264 2/20 0.41
GCGR P47871 2/20 0.41
MAPK12 P53778 2/20 0.41
MAPK11 Q15759 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL14220449 0.92 NT5E (0.68) NT5ENOX1PDGFRBMEN1KMT2A
SCHEMBL1170563 0.87 NT5E (0.74) NT5ENOX1PDGFRBMEN1KMT2A
SCHEMBL15093219 0.83 NT5E (0.80) NT5ENOX1PDGFRBMEN1KMT2A
SCHEMBL12561674 0.82 NT5E (1.00) NT5ENOX1MEN1KMT2AMAPT
SCHEMBL15093318 0.82 NT5E (0.94) NT5ENOX1MEN1KMT2AMAPT
SCHEMBL6468783 0.80 NT5E (0.80) NT5EMEN1KMT2AMAPTMAPK14
SCHEMBL11054293 0.80 NOX1 (0.72) NOX1MEN1KMT2AMAPTHPGD
SCHEMBL5571856 0.80 NT5E (0.74) NT5ENOX1PDGFRBMEN1KMT2A
SCHEMBL12561653 0.78 NT5E (0.85) NT5EPDGFRBMEN1KMT2AMAPT
SCHEMBL17366627 0.78 NT5E (0.85) NT5ENOX1MEN1KMT2AMAPT

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-8987305-B2 2,4,5-trisubstituted imidazoles and their use as anti-microbial agents APTOSE BIOSCIENCES INC. (CA) 2015-03-24 US claimed
US-20130177632-A1 2,4,5-TRISUBSTITUTED IMIDAZOLES AND THEIR USE AS ANTI-MICROBIAL AGENTS APTOSE BIOSCIENCES INC. (CA) 2013-07-11 US claimed
US-20070105929-A1 2, 4, 5 - Trisubstituted Imidazoles And Their Use As Anti-Microbial Agents APTOSE BIOSCIENCES INC. (CA) 2007-05-10 US claimed
EP-1531674-A2 2,4,5-TRISUBSTITUTED IMIDAZOLES AND THEIR USE AS ANTI-MICROBIAL AGENTS Lorus Therapeutics Inc. (CA) 2005-05-25 EP claimed
WO-2004016086-A2 2,4,5-TRISUBSTITUTED IMIDAZOLES AND THEIR USE AS ANTI-MICROBIAL AGENTS LORUS THERAPEUTICS INC. (CA) 2004-02-26 WO claimed
US-8987305-B2 2,4,5-trisubstituted imidazoles and their use as anti-microbial agents APTOSE BIOSCIENCES INC. (CA) 2015-03-24 US disclosed
US-20130177632-A1 2,4,5-TRISUBSTITUTED IMIDAZOLES AND THEIR USE AS ANTI-MICROBIAL AGENTS APTOSE BIOSCIENCES INC. (CA) 2013-07-11 US disclosed
US-8394815-B2 2,4,5-trisubstituted imidazoles and their use as anti-microbial agents LORUS THERAPEUTICS INC. (CA) 2013-03-12 US disclosed
US-20110152337-A1 2,4,5-TRISUBSTITUTED IMIDAZOLES AND THEIR USE AS ANTI-MICROBIAL AGENTS LORUS THERAPEUTICS INC. (CA) 2011-06-23 US disclosed
US-7884120-B2 microbiocides such as 2-(2-methyl-1H-indol-3-yl)-3a,11b-dihydro-1H-phenanthro[9,10-d]imidazole; bactericides; fungicides LORUS THERAPEUTICS INC. (CA) 2011-02-08 US disclosed
US-20070105929-A1 2, 4, 5 - Trisubstituted Imidazoles And Their Use As Anti-Microbial Agents APTOSE BIOSCIENCES INC. (CA) 2007-05-10 US disclosed
EP-1531674-A2 2,4,5-TRISUBSTITUTED IMIDAZOLES AND THEIR USE AS ANTI-MICROBIAL AGENTS Lorus Therapeutics Inc. (CA) 2005-05-25 EP disclosed
WO-2004016086-A2 2,4,5-TRISUBSTITUTED IMIDAZOLES AND THEIR USE AS ANTI-MICROBIAL AGENTS LORUS THERAPEUTICS INC. (CA) 2004-02-26 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 (3 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-20130177632-A1 2,4,5-TRISUBSTITUTED IMIDAZOLES AND THEIR USE AS ANTI-MICROBIAL AGENTS IDO2, ERG28, IL4 NT5E 161/4885NOX1 140/4885PDGFRB 4644/4885
US-20110152337-A1 2,4,5-TRISUBSTITUTED IMIDAZOLES AND THEIR USE AS ANTI-MICROBIAL AGENTS IDO2, ERG28, IL4 NT5E 161/4885NOX1 140/4885PDGFRB 4644/4885
US-20070105929-A1 2, 4, 5 - Trisubstituted Imidazoles And Their Use As Anti-Microbial Agents IDO2, ERG28, IL4 NT5E 161/4885NOX1 140/4885PDGFRB 4644/4885

“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.