SCHEMBL8066261

SCHEMBL8066261

CC(C)c1noc(N2CCC(CCCOc3ccc([C@H](NC(=O)OC(C)(C)C)C(=O)N4CCC[C@H]4N)cc3)CC2)n1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.44
HRH2 P25021 6/20 0.40
HRH1 P35367 6/20 0.40
KCNH2 Q12809 1/20 0.39
GPR183 P32249 1/20 0.38
F2RL3 Q96RI0 2/20 0.35
ACACB O00763 1/20 0.35

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
SCHEMBL13026931 0.92 GPR119 (0.43) GPR119HRH2HRH1KCNH2GPR183
SCHEMBL2890587 0.91 GPR119 (0.43) GPR119HRH2HRH1KCNH2GPR183
SCHEMBL3698390 0.91 GPR119 (0.43) GPR119HRH2HRH1KCNH2GPR183
SCHEMBL2900249 0.91 GPR119 (0.43) GPR119HRH2HRH1KCNH2GPR183
SCHEMBL2890590 0.91 GPR119 (0.43) GPR119HRH2HRH1KCNH2GPR183
SCHEMBL3698393 0.91 GPR119 (0.43) GPR119HRH2HRH1KCNH2GPR183
SCHEMBL2900245 0.91 GPR119 (0.43) GPR119HRH2HRH1KCNH2GPR183
SCHEMBL8074091 0.91 HRH2 (0.37) GPR119HRH2HRH1KCNH2GPR183
SCHEMBL2897872 0.90 GPR119 (0.48) GPR119HRH2HRH1KCNH2GPR183
SCHEMBL2898500 0.88 GPR119 (0.49) GPR119HRH2HRH1KCNH2GPR183

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
WO-2009034388-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2009-03-19 WO disclosed