SCHEMBL3829327

SCHEMBL3829327

COc1ccc2ncc(F)c(CCN3CC(=NO)C(CNC(=O)O)C3)c2n1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.49
KCNH2 Q12809 12/20 0.48

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
SCHEMBL3273002 1.00 SLC2A1 (0.49) SLC2A1KCNH2
SCHEMBL3272992 1.00 SLC2A1 (0.49) SLC2A1KCNH2
SCHEMBL13382303 0.89 SLC2A1 (0.43) SLC2A1KCNH2
SCHEMBL13382578 0.89 SLC2A1 (0.43) SLC2A1KCNH2
SCHEMBL3273323 0.87 KCNH2 (0.47) SLC2A1KCNH2
SCHEMBL3273321 0.87 KCNH2 (0.47) SLC2A1KCNH2
SCHEMBL3373314 0.85 SLC2A1 (0.56) SLC2A1KCNH2
SCHEMBL3842515 0.82 KCNH2 (0.55) SLC2A1KCNH2
SCHEMBL3842504 0.82 KCNH2 (0.55) SLC2A1KCNH2
SCHEMBL3842508 0.82 KCNH2 (0.55) SLC2A1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1796466-A4 ANTIBACTERIAL AGENTS GLAXO GROUP LTD (GB) 2009-09-02 EP disclosed
EP-1796466-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2007-06-20 EP disclosed
WO-2006002047-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2006-01-05 WO disclosed