SCHEMBL27765347

SCHEMBL27765347

CS(=O)(=O)c1ccc(C(CC(=O)Cl)C2CC(=O)C2)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 4/20 0.42
▸ KCNH2 Q12809 2/20 0.39
▸ SLC6A2 P23975 5/20 0.37
▸ SLC6A4 P31645 5/20 0.37
▸ SLC6A3 Q01959 5/20 0.37
▸ PTGDR Q13258 6/20 0.33
▸ TBXA2R P21731 3/20 0.33
▸ TRPV4 Q9HBA0 1/20 0.33
▸ PIK3CD O00329 1/20 0.33
▸ PIK3CA P42336 1/20 0.33
▸ PIK3CB P42338 1/20 0.33
▸ PIK3CG P48736 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ ADRA1D P25100 1/20 0.32
▸ PDE2A O00408 2/20 0.31

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
SCHEMBL27765343 1.00 GCK (0.42) GCKKCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL27765336 0.91 GCK (0.42) GCKKCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL27558109 0.82 GCK (0.47) GCKKCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL27578470 0.82 GCK (0.47) GCKKCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL27558086 0.79 GCK (0.44) GCKKCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL27502236 0.77 KCNH2 (0.46) GCKKCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL27467646 0.77 KCNH2 (0.46) GCKKCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL1858972 0.76 GCK (0.55) GCKKCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL1858970 0.76 GCK (0.55) GCKKCNH2SLC6A2SLC6A4SLC6A3
SCHEMBL27616381 0.76 KCNH2 (0.45) GCKKCNH2SLC6A2SLC6A4SLC6A3

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
CN-101541756-A Pyrazoles as glucokinase activators HOFFMANN LA ROCHE (CH) 2009-09-23 — — CN disclosed
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