SCHEMBL2923635

SCHEMBL2923635

COc1cccc2c(-c3ccc(CCNCc4ccc5c(n4)NC(=O)CO5)cc3)ccnc12

nearest known ligand 0.45

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 20/20 0.45

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
SCHEMBL1376513 0.83 KCNH2 (0.58) KCNH2
SCHEMBL2925502 0.82 KCNH2 (0.57) KCNH2
SCHEMBL4716097 0.75 CCR8 (0.49) KCNH2
SCHEMBL2919418 0.74 KCNH2 (0.55) KCNH2
SCHEMBL2925090 0.73 KCNH2 (0.41) KCNH2
SCHEMBL4066049 0.73 KCNH2 (0.43) KCNH2
SCHEMBL16649510 0.71 KCNH2 (0.53) KCNH2
SCHEMBL3377792 0.71 KCNH2 (0.50) KCNH2
SCHEMBL5253483 0.70 KCNH2 (0.54) KCNH2
SCHEMBL2923666 0.69 KCNH2 (0.45) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1560488-B1 ANTIBACTERIAL AGENTS GLAXO GROUP LTD (GB) 2010-09-01 EP claimed