SCHEMBL470585

SCHEMBL470585

CCc1noc(N2CCC([C@H](C)Oc3cnc(N4CC[C@@H](N)C4)nc3)CC2)n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.35
GPR183 P32249 1/20 0.35
HRH4 Q9H3N8 3/20 0.34
ACACB O00763 4/20 0.34
AOC3 Q16853 2/20 0.33
MKNK1 Q9BUB5 1/20 0.33
MKNK2 Q9HBH9 1/20 0.33
LRRK2 Q5S007 2/20 0.33
KCNH2 Q12809 2/20 0.33
HRH3 Q9Y5N1 1/20 0.32
ALOX5AP P20292 1/20 0.32
PIP5K1C O60331 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
RIPK4 P57078 1/20 0.32
MAP2K5 Q13163 1/20 0.32
CAMK1 Q14012 1/20 0.32
MAP3K11 Q16584 1/20 0.32
PNCK Q6P2M8 1/20 0.32
CAMK1D Q8IU85 1/20 0.32

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
SCHEMBL470661 0.87 GPR119 (0.47) GPR119GPR183HRH4ACACBMKNK1
SCHEMBL470625 0.86 GPR119 (0.33) GPR119GPR183ACACBALOX5AP
SCHEMBL12064853 0.81 ALDH1A1 (0.34) GPR119GPR183KCNH2
SCHEMBL462545 0.80 GPR119 (0.32) GPR119GPR183ACACBALOX5AP
SCHEMBL462547 0.80 GPR119 (0.32) GPR119GPR183ACACBALOX5AP
SCHEMBL462546 0.80 GPR119 (0.32) GPR119GPR183ACACBALOX5AP
SCHEMBL470695 0.79 DPP4 (0.39) GPR119KCNH2
SCHEMBL463069 0.79 GPR119 (0.32) GPR119GPR183
SCHEMBL463068 0.79 GPR119 (0.32) GPR119GPR183
SCHEMBL470902 0.79 DPP4 (0.34) GPR119GPR183ACACBKCNH2

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-2011147951-A1 CYCLOAMINO DERIVATIVES AS GPR119 ANTAGONISTS PROSIDION LIMITED (GB) 2011-12-01 WO disclosed