SCHEMBL17020

SCHEMBL17020

CC(=O)N(C[C@@]1(c2ccc(C(C)(O)C(F)(F)F)cc2)CN(S(=O)(=O)C2=CC=CCC2=S)CCN1)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 12/20 0.32
RORC P51449 2/20 0.32
NR1I2 O75469 1/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
KCNH2 Q12809 2/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL18402 0.88 HSD11B1 (0.32) HSD11B1RORCKCNH2CYP3A4
SCHEMBL16912 0.86 HSD11B1 (0.34) HSD11B1RORCNR1I2KCNH2CYP3A4
SCHEMBL16074 0.86 HSD11B1 (0.34) HSD11B1RORCNR1I2KCNH2CYP3A4
SCHEMBL18340 0.85 HSD11B1 (0.32) HSD11B1RORCNR1I2KCNH2CYP3A4
SCHEMBL16811 0.85 HSD11B1 (0.31) HSD11B1RORC
SCHEMBL18291 0.85 HSD11B1 (0.39) HSD11B1RORCNR1I2NR1H2NR1H3
Hydrochloric Acid SCHEMBL17176 0.85 HSD11B1 (0.34) HSD11B1RORCNR1I2KCNH2CYP3A4
SCHEMBL16710 0.84 HSD11B1 (0.31) HSD11B1
SCHEMBL17936 0.84 HSD11B1 (0.31) HSD11B1KCNH2CYP3A4
SCHEMBL17389 0.83 HSD11B1 (0.35) HSD11B1RORCNR1I2NR1H2NR1H3

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