SCHEMBL3843875

SCHEMBL3843875

O=C(O)N(Cc1cc2c(cn1)OCCO2)C1CCN(CCn2c(=O)nnc3ccc(Cl)c(O)c32)CC1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 18/20 0.41
SLC2A1 P11166 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
SCHEMBL4141691 0.79 KCNH2 (0.56) KCNH2SLC2A1
SCHEMBL4136243 0.79 KCNH2 (0.52) KCNH2
SCHEMBL3517716 0.78 KCNH2 (0.52) KCNH2
SCHEMBL4135802 0.77 KCNH2 (0.49) KCNH2
SCHEMBL4128222 0.77 KCNH2 (0.55) KCNH2
SCHEMBL4153148 0.76 KCNH2 (0.52) KCNH2
SCHEMBL4296810 0.76 KCNH2 (0.57) KCNH2
SCHEMBL4145112 0.76 KCNH2 (0.56) KCNH2
SCHEMBL4299494 0.76 TMEM97 (0.48) KCNH2
SCHEMBL4141033 0.75 KCNH2 (0.49) 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-2044077-A1 DERIVATIVES AND ANALOGS OF N-ETHYLQUINOLONES AND N-ETHYLAZAQUINOLONES Glaxo Group Limited (GB) 2009-04-08 EP disclosed
WO-2008009700-A1 DERIVATIVES AND ANALOGS OF N-ETHYLQUINOLONES AND N-ETHYLAZAQUINOLONES GLAXO GROUP LIMITED (GB) 2008-01-24 WO disclosed