SCHEMBL4350684

SCHEMBL4350684

COc1ccc2ncc(F)c(C[C@@H](O)CO)c2n1

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.42

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
SCHEMBL3430268 1.00 KCNH2 (0.42) KCNH2
SCHEMBL4350687 1.00 KCNH2 (0.42) KCNH2
SCHEMBL4214405 0.90 KCNH2 (0.36) KCNH2
SCHEMBL4214402 0.90 KCNH2 (0.36) KCNH2
SCHEMBL1838608 0.85 KCNH2 (0.39) KCNH2
SCHEMBL1951359 0.84 KCNH2 (0.45) KCNH2
SCHEMBL3404974 0.82 KCNH2 (0.41) KCNH2
SCHEMBL2819381 0.82 KCNH2 (0.45) KCNH2
SCHEMBL14388369 0.82 KCNH2 (0.48) KCNH2
SCHEMBL1712573 0.80 KCNH2 (0.46) 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-2041145-A1 AZATRICYCLIC COMPOUNDS AND THEIR USE Glaxo Group Limited (GB) 2009-04-01 EP disclosed
WO-2008003690-A1 AZATRICYCLIC COMPOUNDS AND THEIR USE GLAXO GROUP LIMITED (GB) 2008-01-10 WO disclosed