SCHEMBL6561897

SCHEMBL6561897

O=C(Nc1n[c]cs1)C(CC1CCCC1)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 1/20 0.48
KCNH2 Q12809 3/20 0.47
GCK P35557 12/20 0.46
SLC6A3 Q01959 3/20 0.38
KCNQ2 O43526 1/20 0.38

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
SCHEMBL6563797 0.89 FFAR2 (0.62) FFAR2KCNH2GCK
SCHEMBL6562292 0.88 KCNH2 (0.63) FFAR2KCNH2GCK
SCHEMBL6563369 0.87 FFAR2 (0.48) FFAR2KCNH2GCKKCNQ2
SCHEMBL6561977 0.84 GCK (0.51) FFAR2KCNH2GCK
SCHEMBL2645075 0.82 FFAR2 (0.72) FFAR2KCNH2GCK
SCHEMBL2646196 0.82 FFAR2 (0.49) FFAR2KCNH2GCKSLC6A3KCNQ2
SCHEMBL2657079 0.82 FFAR2 (0.72) FFAR2KCNH2GCK
SCHEMBL2645076 0.82 FFAR2 (0.72) FFAR2KCNH2GCK
SCHEMBL2658486 0.82 FFAR2 (0.49) FFAR2KCNH2GCKSLC6A3KCNQ2
SCHEMBL6563227 0.82 KCNH2 (0.49) FFAR2KCNH2GCK

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

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