SCHEMBL4793249

SCHEMBL4793249

COc1ccc2nccc(NC(=O)C3CCC(NC(=O)O)CO3)c2n1

nearest known ligand 0.64

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 7/20 0.51

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
SCHEMBL4500713 1.00 KCNH2 (0.51) KCNH2
SCHEMBL4772967 0.89 KCNH2 (0.48) KCNH2
SCHEMBL4512253 0.85 KCNH2 (0.49) KCNH2
SCHEMBL4522089 0.79 KCNH2 (0.81) KCNH2
SCHEMBL5636821 0.77 KCNH2 (0.57) KCNH2
SCHEMBL4511568 0.76 KCNH2 (0.45) KCNH2
SCHEMBL14128010 0.75 KCNH2 (0.49) KCNH2
SCHEMBL633958 0.73 KCNH2 (0.54) KCNH2
SCHEMBL5905772 0.73 CYP8B1 (0.49) KCNH2
SCHEMBL2332033 0.72 KCNH2 (0.41) KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1891078-A1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY AstraZeneca AB (SE) 2008-02-27 EP disclosed
WO-2006125974-A1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY ASTRAZENECA AB (SE) 2006-11-30 WO disclosed