Sugi Predict

Sugi Predict / Compounds / SCHEMBL3804166

SCHEMBL3804166

SCHEMBL3804166

CC(C)c1noc(N2CCC([C@H](C)CCOc3ccc(CC(NC(=O)OC(C)(C)C)C(=O)N4CCC(F)(F)C4)c(F)c3)CC2)n1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 6/20 0.46
▸ KCNH2 Q12809 2/20 0.46
▸ HRH2 P25021 6/20 0.37
▸ HRH1 P35367 6/20 0.37
▸ HRH3 Q9Y5N1 8/20 0.36

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
SCHEMBL2894873 1.00 GPR119 (0.46) GPR119KCNH2HRH2HRH1HRH3
SCHEMBL2894865 1.00 GPR119 (0.46) GPR119KCNH2HRH2HRH1HRH3
SCHEMBL2891044 0.96 GPR119 (0.47) GPR119KCNH2HRH2HRH1HRH3
SCHEMBL2891048 0.96 GPR119 (0.47) GPR119KCNH2HRH2HRH1HRH3
SCHEMBL2897197 0.92 GPR119 (0.48) GPR119KCNH2HRH2HRH1HRH3
SCHEMBL2890673 0.90 GPR119 (0.48) GPR119KCNH2HRH3
SCHEMBL2899111 0.90 GPR119 (0.48) GPR119KCNH2HRH3
SCHEMBL2890667 0.90 GPR119 (0.48) GPR119KCNH2HRH3
SCHEMBL2895540 0.89 GPR119 (0.49) GPR119KCNH2HRH2HRH1HRH3
SCHEMBL2897187 0.89 GPR119 (0.49) GPR119KCNH2HRH2HRH1HRH3

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-2200609-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS Prosidion Limited (GB) 2010-06-30 — — EP disclosed
WO-2009034388-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2009-03-19 — — WO disclosed