SCHEMBL18907

SCHEMBL18907

CC[C@@H](C#Cc1cc(C(O)(C(F)(F)F)C(F)(F)F)ccc1N1CCN(S(=O)(=O)c2cccs2)CC1)OC

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GCKR Q14397 18/20 0.56
GCK P35557 1/20 0.56
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL15748 1.00 GCKR (0.56) GCKRGCKGAAMAPTTSHR
SCHEMBL14899161 1.00 GCKR (0.56) GCKRGCKGAAMAPTTSHR
SCHEMBL12089583 0.92 MAPT (0.46) GCKRGCKGAAMAPTTSHR
SCHEMBL12089903 0.92 MAPT (0.46) GCKRGCKGAAMAPTTSHR
SCHEMBL19488 0.90 GCKR (0.58) GCKRGCKGAAMAPTTSHR
SCHEMBL15835 0.90 GCKR (0.58) GCKRGCKGAAMAPTTSHR
SCHEMBL20260 0.90 GCKR (0.58) GCKRGCKGAAMAPTTSHR
SCHEMBL17077 0.89 GCKR (0.56) GCKRGCK
SCHEMBL16409 0.89 GCKR (0.56) GCKRGCK
SCHEMBL16968 0.89 GCKR (0.56) GCKRGCK

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
US-8431563-B2 Compounds that interact with glucokinase regulatory protein for the treatment of diabetes AMGEN INC. (US) 2013-04-30 US 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