SCHEMBL5133249

SCHEMBL5133249

CC(C)c1noc(N2CCC(Oc3ccnc4c(-c5ccc(F)cc5S(C)(=O)=O)cccc34)CC2)n1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C19 P33261 1/20 0.49
HRH3 Q9Y5N1 1/20 0.39
GPR183 P32249 1/20 0.39
KCNH2 Q12809 1/20 0.36
AR P10275 1/20 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
SCHEMBL385846 0.90 GPR119 (0.51) GPR119CYP3A4CYP2C19HRH3GPR183
SCHEMBL390901 0.88 GPR119 (0.63) GPR119CYP3A4CYP2C19GPR183KCNH2
SCHEMBL390993 0.85 GPR119 (0.55) GPR119CYP3A4CYP2C19GPR183KCNH2
SCHEMBL389546 0.85 GPR119 (0.47) GPR119CYP3A4CYP2C19HRH3KCNH2
SCHEMBL13404852 0.82 GPR119 (0.47) GPR119CYP3A4CYP2C19HRH3AR
SCHEMBL388856 0.81 GPR119 (0.46) GPR119CYP3A4CYP2C19HRH3AR
SCHEMBL390698 0.81 GPR119 (0.44) GPR119CYP3A4CYP2C19HRH3AR
SCHEMBL389484 0.80 GPR119 (0.52) GPR119CYP3A4CYP2C19GPR183KCNH2
SCHEMBL389924 0.79 HRH3 (0.39) GPR119CYP3A4CYP2C19HRH3
SCHEMBL14526640 0.78 GPR119 (0.41) GPR119CYP3A4CYP2C19HRH3AR

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-2004157-A2 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AS WELL AS COMBINATION THERAPY RELATING THERETO Arena Pharmaceuticals, Inc. (US) 2008-12-24 EP disclosed
WO-2007120702-A2 USE OF GPR119 RECEPTOR AGONISTS FOR INCREASING BONE MASS AND FOR TREATING OSTEOPOROSIS, AND COMBINATION THERAPY RELATING THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-10-25 WO disclosed