SCHEMBL470574

SCHEMBL470574

CC(C)c1noc(C(=O)N2CCC(COc3cnc(N4CC[C@@H](N)C4)nc3)CC2)n1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.45
GPR183 P32249 1/20 0.45
ACACB O00763 2/20 0.42
ABCB1 P08183 1/20 0.37
ABCC1 P33527 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
KCNH2 Q12809 2/20 0.36
CAMK1D Q8IU85 2/20 0.35
PIP5K1C O60331 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RIPK4 P57078 1/20 0.35
MAP2K5 Q13163 1/20 0.35
CAMK1 Q14012 1/20 0.35
MAP3K11 Q16584 1/20 0.35
PNCK Q6P2M8 1/20 0.35
CAMK1G Q96NX5 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
SCHEMBL470632 0.85 GPR119 (0.58) GPR119GPR183ACACBABCB1ABCC1
SCHEMBL12064582 0.83 GPR119 (0.40) GPR119GPR183ACACB
SCHEMBL462956 0.82 DPP4 (0.39) GPR119GPR183KCNH2
SCHEMBL462923 0.72 GPR119 (0.40) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL461048 0.72 HTR2C (0.41) GPR119
SCHEMBL13186518 0.71 GPR119 (0.44) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL470661 0.71 GPR119 (0.47) GPR119GPR183ACACBKCNH2CAMK1D
SCHEMBL461135 0.70 GPR119 (0.61) GPR119GPR183ABCB1ABCC1ABCG2
SCHEMBL470700 0.69 GPR119 (0.53) GPR119GPR183ACACBABCB1ABCC1
SCHEMBL470613 0.68 GPR119 (0.49) GPR119GPR183KCNH2

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