SCHEMBL5772093

SCHEMBL5772093

COc1ccc2nccc(NC(=O)ON3CCC(NCc4nc5c(F)cc(F)cc5[nH]4)CC3)c2n1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 4/20 0.47
KCNH2 Q12809 10/20 0.46

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
SCHEMBL13857006 0.91 SLC2A1 (0.48) SLC2A1KCNH2
SCHEMBL5797424 0.83 SLC2A1 (0.64) SLC2A1KCNH2
SCHEMBL4270084 0.80 SLC2A1 (0.68) SLC2A1KCNH2
SCHEMBL5774180 0.77 KCNH2 (0.42) SLC2A1KCNH2
SCHEMBL13857009 0.73 SLC2A1 (0.65) SLC2A1KCNH2
SCHEMBL5765657 0.71 KCNH2 (0.47) SLC2A1KCNH2
SCHEMBL4270115 0.71 SLC2A1 (0.64) SLC2A1KCNH2
SCHEMBL4274078 0.71 PARP1 (0.41) KCNH2
SCHEMBL7150097 0.70 SLC2A1 (0.66) SLC2A1KCNH2
SCHEMBL14573148 0.69 KCNH2 (0.47) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1305308-B1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 2006-12-20 EP claimed