SCHEMBL6561985

SCHEMBL6561985

COC(=O)Oc1cnc(NC(=O)C(CC2CCCC2)c2ccc(Cl)c(Cl)c2)s1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.51
GCK P35557 10/20 0.47
FFAR2 O15552 1/20 0.44
SLC6A3 Q01959 6/20 0.43

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
SCHEMBL6561820 0.93 KCNH2 (0.48) KCNH2GCKFFAR2SLC6A3
SCHEMBL6563673 0.92 KCNH2 (0.49) KCNH2GCKFFAR2SLC6A3
SCHEMBL2646265 0.86 FFAR2 (0.52) KCNH2GCKFFAR2
SCHEMBL2648959 0.86 GCK (0.58) KCNH2GCKFFAR2
SCHEMBL2646014 0.83 KCNH2 (0.49) KCNH2GCKFFAR2
SCHEMBL2647073 0.83 KCNH2 (0.49) KCNH2GCKFFAR2
SCHEMBL2657060 0.83 KCNH2 (0.49) KCNH2GCKFFAR2
SCHEMBL2659129 0.83 KCNH2 (0.49) KCNH2GCKFFAR2
SCHEMBL2648308 0.82 KCNH2 (0.49) KCNH2GCKFFAR2
SCHEMBL6563810 0.82 KCNH2 (0.45) KCNH2GCKFFAR2SLC6A3

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-1169312-B1 GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2004-10-06 EP claimed