SCHEMBL4844138

SCHEMBL4844138

Clc1cnc2nc(-c3ccc(N4CCOCC4)cc3)[nH]c2c1Cl

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TBK1 Q9UHD2 7/20 0.61
AURKA O14965 7/20 0.57
INSR P06213 3/20 0.55
ALK Q9UM73 3/20 0.55
IKBKE Q14164 2/20 0.51
KCNH2 Q12809 1/20 0.48
PRMT5 O14744 1/20 0.44
CNR2 P34972 1/20 0.44

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
SCHEMBL4842982 0.76 AURKA (0.68) TBK1AURKAIKBKEPRMT5
SCHEMBL4843679 0.76 TBK1 (0.78) TBK1INSRALKIKBKE
SCHEMBL4844250 0.74 TBK1 (0.58) TBK1AURKAIKBKE
SCHEMBL4843136 0.74 TBK1 (0.74) TBK1AURKAIKBKEKCNH2
SCHEMBL17290061 0.72 PARP1 (0.46) TBK1AURKAINSRALKCNR2
SCHEMBL4186428 0.71 AURKA (0.52) TBK1AURKAINSRALKKCNH2
SCHEMBL17306376 0.71 PARP1 (0.45) TBK1INSRALKCNR2
SCHEMBL4834884 0.70 TBK1 (0.75) TBK1IKBKE
SCHEMBL17289610 0.69 PARP1 (0.51) TBK1INSRALKPRMT5CNR2
SCHEMBL4834315 0.69 TBK1 (0.73) TBK1IKBKE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1539759-B1 NOVEL IMIDAZOPYRIDINES AND THEIR USE ASTRAZENECA AB (SE) 2007-08-15 EP claimed
US-7410966-B2 Use of and some novel imidazopyridines ASTRAZENECA AB (SE) 2008-08-12 US disclosed
EP-1539759-B1 NOVEL IMIDAZOPYRIDINES AND THEIR USE ASTRAZENECA AB (SE) 2007-08-15 EP disclosed
US-20050261333-A1 Use of and some novel imidazopyridines ASTRAZENECA A B (SE) 2005-11-24 US 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 (1 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-20050261333-A1 Use of and some novel imidazopyridines ITK, CSNK1A1, RPS6KA1 TBK1 1029/4885AURKA 512/4885INSR 97/4885

“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.