SCHEMBL4838864

SCHEMBL4838864

NC(=O)C1CCCN1CC(O)COc1ccc(-c2nc3cc(Br)cnc3[nH]2)cc1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 14/20 0.39
RECQL P46063 1/20 0.38
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL4838868 1.00 CHEK2 (0.39) CHEK2RECQLMAOAMAOBNPSR1
Trifluoroacetic Acid SCHEMBL4846072 0.95 CHEK2 (0.37) CHEK2RECQLMAOAMAOB
Trifluoroacetic Acid SCHEMBL4846064 0.95 CHEK2 (0.37) CHEK2RECQLMAOAMAOB
SCHEMBL4834384 0.87 CHEK2 (0.45) CHEK2
SCHEMBL4834392 0.87 CHEK2 (0.45) CHEK2
SCHEMBL4840676 0.86 MEN1 (0.43) CHEK2NPSR1
SCHEMBL4839154 0.85 MEN1 (0.42)
SCHEMBL4834675 0.84 KMT2A (0.39) CHEK2RECQLNPSR1
SCHEMBL5257250 0.83 MEN1 (0.42) CHEK2NPSR1
SCHEMBL5258053 0.82 MEN1 (0.40) CHEK2NPSR1

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 309/4885RECQL 519/4885MAOA 1425/4885

“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.