SCHEMBL4834384

SCHEMBL4834384

NC(=O)C1CCCN1CCOc1ccc(-c2nc3cc(Br)cnc3[nH]2)cc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 14/20 0.45
LTA4H P09960 2/20 0.41
IKBKE Q14164 2/20 0.40
TBK1 Q9UHD2 2/20 0.40
CDK2 P24941 1/20 0.40
AURKB Q96GD4 1/20 0.40
ACHE P22303 1/20 0.39
AXL P30530 1/20 0.39
BACE1 P56817 1/20 0.39

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
SCHEMBL4834392 1.00 CHEK2 (0.45) CHEK2LTA4HIKBKETBK1CDK2
Trifluoroacetic Acid SCHEMBL4844127 0.94 CHEK2 (0.42) CHEK2LTA4HIKBKETBK1CDK2
Trifluoroacetic Acid SCHEMBL4844135 0.94 CHEK2 (0.42) CHEK2LTA4HIKBKETBK1CDK2
SCHEMBL6245898 0.87 CHEK2 (0.41) CHEK2IKBKETBK1CDK2AURKB
SCHEMBL6245899 0.87 CHEK2 (0.41) CHEK2IKBKETBK1CDK2AURKB
SCHEMBL4838868 0.87 CHEK2 (0.39) CHEK2
SCHEMBL4838864 0.87 CHEK2 (0.39) CHEK2
SCHEMBL4838273 0.86 CHEK2 (0.51) CHEK2LTA4HIKBKETBK1CDK2
SCHEMBL4842393 0.85 CHEK2 (0.50) CHEK2LTA4HIKBKETBK1CDK2
SCHEMBL4843811 0.82 TBK1 (0.46) CHEK2IKBKETBK1ACHE

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 5 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-20050261333-A1 Use of and some novel imidazopyridines ASTRAZENECA A B (SE) 2005-11-24 US 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 CHEK2 309/4885LTA4H 2694/4885IKBKE 95/4885

“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.