SCHEMBL6563666

SCHEMBL6563666

COC(=O)Oc1csc(NC(=O)C(CC2CCCC2)c2cccc(Cl)c2)n1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 1/20 0.43
KCNH2 Q12809 1/20 0.42
GCK P35557 13/20 0.42
ROCK2 O75116 1/20 0.41
ROCK1 Q13464 1/20 0.41
KCNQ2 O43526 1/20 0.40

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
SCHEMBL6563294 0.93 L3MBTL1 (0.41) FFAR2KCNH2GCKROCK2ROCK1
SCHEMBL6563774 0.89 FFAR2 (0.56) FFAR2KCNH2GCK
SCHEMBL6563810 0.88 KCNH2 (0.45) FFAR2KCNH2GCK
SCHEMBL2658530 0.86 L3MBTL1 (0.46) FFAR2KCNH2GCKROCK2ROCK1
SCHEMBL2644873 0.86 L3MBTL1 (0.46) FFAR2KCNH2GCKROCK2ROCK1
SCHEMBL2645895 0.85 SMN1; SMN2 (0.48) FFAR2KCNH2GCK
SCHEMBL2657991 0.85 SMN1; SMN2 (0.48) FFAR2KCNH2GCK
SCHEMBL6595816 0.84 GCK (0.53) FFAR2KCNH2GCK
SCHEMBL6561839 0.83 GCK (0.48) FFAR2KCNH2GCK
SCHEMBL27548008 0.83 FFAR2 (0.46) FFAR2KCNH2GCKROCK2ROCK1

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