SCHEMBL2668071

SCHEMBL2668071

CCS(=O)(=O)c1ccc(Oc2cc(OC(C)COC)cc(-c3nc4cccnc4[nH]3)c2)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GCK P35557 15/20 0.43
SCD O00767 1/20 0.37
KCNH2 Q12809 1/20 0.36
CYP1A2 P05177 3/20 0.36
CYP3A4 P08684 3/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL2087567 1.00 GCK (0.43) GCKSCDKCNH2CYP1A2CYP3A4
SCHEMBL2086592 0.94 GCK (0.42) GCKKCNH2
SCHEMBL2085254 0.83 GCK (0.49) GCK
SCHEMBL708896 0.83 GCK (0.52) GCKKCNH2
SCHEMBL708895 0.83 GCK (0.52) GCKKCNH2
SCHEMBL2087976 0.81 GCK (0.41) GCKKCNH2
SCHEMBL2085163 0.81 GCK (0.44) GCKKCNH2
SCHEMBL2088032 0.81 GCK (0.46) GCKKCNH2
SCHEMBL2668030 0.79 GCK (0.41) GCKKCNH2
SCHEMBL2086073 0.78 GCK (0.41) GCKSCDKCNH2

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
WO-2006125958-A1 2-PHENYL SUBSTITUTED IMIDAZOL [4 , 5B] PYRIDINE/ PYRAZINE AND PURINE DERIVATIVES AS GLUCOKINASE MODULATORS ASTRAZENECA AB (SE) 2006-11-30 WO disclosed