SCHEMBL17056

SCHEMBL17056

C[C@](O)(c1ccc(N2CCN(CC#CS(=O)(=O)c3ccc(Cl)nc3)CC2)cc1)C(F)(F)F

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCK P35557 7/20 0.52
GCKR Q14397 3/20 0.52
GLRA3 O75311 1/20 0.39
GLRB P48167 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP2D6 P10635 1/20 0.39
HSD11B1 P28845 7/20 0.38
MLYCD O95822 1/20 0.38
CHRM1 P11229 1/20 0.36
NR1H2 P55055 2/20 0.36
NR1H3 Q13133 2/20 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
SCHEMBL16675 0.89 GCK (0.67) GCKGCKR
SCHEMBL16932 0.89 GCK (0.67) GCKGCKR
SCHEMBL18383 0.89 GCK (0.67) GCKGCKR
SCHEMBL21050 0.81 GCK (0.77) GCKGCKRALDH1A1CYP2D6HSD11B1
SCHEMBL17687 0.80 GCK (0.66) GCKGCKR
SCHEMBL15201362 0.79 GCK (0.55) GCKGCKR
SCHEMBL15200890 0.79 GCK (0.55) GCKGCKR
SCHEMBL15201628 0.79 GCK (0.47) GCKGCKRMLYCDCHRM1
SCHEMBL18058 0.78 GCK (0.52) GCKGCKR
SCHEMBL16115 0.78 GCK (0.52) GCKGCKR

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-2609081-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES Amgen Inc. (US) 2013-07-03 EP disclosed
WO-2012027261-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-03-01 WO disclosed