SCHEMBL21749

SCHEMBL21749

O=S(=O)(c1ccccc1)N1CCN[C@](CN2C3COCC2C(O)C3)(c2ncc(C(O)(C(F)(F)F)C(F)(F)F)cn2)C1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RORC P51449 4/20 0.39
GCK P35557 13/20 0.37
CCR6 P51684 1/20 0.32
NR1H3 Q13133 1/20 0.32
GCKR Q14397 1/20 0.32

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
SCHEMBL16127 0.85 GCK (0.34) GCK
SCHEMBL16349 0.83 GCK (0.38) RORCGCKGCKR
SCHEMBL17033 0.82 GCK (0.46) GCKGCKR
SCHEMBL16652 0.79 GCK (0.37) RORCGCKGCKR
SCHEMBL17034 0.79 GCK (0.39) GCK
SCHEMBL17625 0.76 GCK (0.56) GCKGCKR
SCHEMBL17079 0.76 GCK (0.56) GCKGCKR
SCHEMBL12079125 0.76 GCK (0.56) GCKGCKR
SCHEMBL12093433 0.76 GCK (0.56) GCKGCKR
SCHEMBL16486 0.75 GCK (0.30) GCK

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