SCHEMBL470602

SCHEMBL470602

CC(C)c1nnc(N2CCC(COc3cnc(N4C[C@H](c5cc(F)ccc5F)[C@@H](N)C4)nc3)CC2)o1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 3/20 0.43
GPR119 Q8TDV5 5/20 0.40
DPP4 P27487 3/20 0.38
KCNH2 Q12809 2/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38
ACACB O00763 2/20 0.34
GPR183 P32249 1/20 0.34
FFAR1 O14842 1/20 0.33
DRD4 P21917 4/20 0.33
DRD2 P14416 3/20 0.33
HTR2A P28223 3/20 0.33
HTR1A P08908 1/20 0.33
KIT P10721 1/20 0.33
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33

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
SCHEMBL470554 0.86 MCHR1 (0.43) MCHR1GPR119DPP4KCNH2DPP8
SCHEMBL470604 0.85 GPR119 (0.49) MCHR1GPR119DPP4KCNH2DPP8
SCHEMBL470611 0.84 MCHR1 (0.49) MCHR1GPR119DPP4KCNH2DPP8
SCHEMBL12064704 0.83 GPR119 (0.36) MCHR1GPR119ACACB
SCHEMBL12064536 0.83 MCHR1 (0.49) MCHR1GPR119DPP4KCNH2DPP8
SCHEMBL470860 0.80 MCHR1 (0.43) MCHR1GPR119DPP4KCNH2DPP8
Hydrochloric Acid SCHEMBL462044 0.80 MCHR1 (0.42) MCHR1GPR119DPP4KCNH2DPP8
SCHEMBL470612 0.79 MCHR1 (0.45) MCHR1GPR119DPP4KCNH2DPP8
SCHEMBL470572 0.79 MCHR1 (0.51) MCHR1DPP4KCNH2DPP8DPP9
SCHEMBL12064733 0.79 MCHR1 (0.44) MCHR1GPR119DPP4KCNH2DPP8

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