Sugi Predict

Sugi Predict / Compounds / SCHEMBL16815

SCHEMBL16815

SCHEMBL16815

CC1(C)NC(=O)N(C[C@@]2(c3ccc(C(C)(O)C(F)(F)F)cc3)CN(S(=O)(=O)C3=CC=CCC3=S)CCN2)C1=O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 6/20 0.32
▸ ATAD2 Q6PL18 2/20 0.31
▸ CECR2 Q9BXF3 1/20 0.31
▸ KCNH2 Q12809 3/20 0.31
▸ CYP3A4 P08684 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
SCHEMBL17495 0.86 HSD11B1 (0.34) HSD11B1KCNH2CYP3A4
SCHEMBL16591 0.85 — —
SCHEMBL18310 0.84 HSD11B1 (0.34) HSD11B1KCNH2CYP3A4
SCHEMBL16912 0.84 HSD11B1 (0.34) HSD11B1KCNH2CYP3A4
SCHEMBL16074 0.84 HSD11B1 (0.34) HSD11B1KCNH2CYP3A4
SCHEMBL17321 0.84 HSD11B1 (0.35) HSD11B1KCNH2CYP3A4
SCHEMBL16798 0.83 HSD11B1 (0.32) HSD11B1KCNH2CYP3A4
Hydrochloric Acid SCHEMBL17176 0.83 HSD11B1 (0.34) HSD11B1KCNH2CYP3A4
SCHEMBL17232 0.83 HSD11B1 (0.33) HSD11B1KCNH2CYP3A4
SCHEMBL17315 0.82 HSD11B1 (0.32) HSD11B1KCNH2CYP3A4

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