SCHEMBL1724437

SCHEMBL1724437

CC(C)OC(=O)N1CCC(C(C)COc2cnc(N3C[C@@H](N)[C@@H](c4cc(F)ccc4F)C3)nc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 16/20 0.44
MCHR1 Q99705 3/20 0.41
DPP4 P27487 2/20 0.39
KCNH2 Q12809 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39

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
SCHEMBL121217 1.00 GPR119 (0.44) GPR119MCHR1DPP4KCNH2DPP8
SCHEMBL120100 1.00 GPR119 (0.44) GPR119MCHR1DPP4KCNH2DPP8
SCHEMBL121276 0.93 MCHR1 (0.43) GPR119MCHR1DPP4KCNH2DPP8
SCHEMBL148547 0.92 GPR119 (0.38) GPR119MCHR1
SCHEMBL152941 0.92 GPR119 (0.38) GPR119MCHR1
SCHEMBL462389 0.90 MCHR1 (0.41) GPR119MCHR1DPP4KCNH2DPP8
Hydrochloric Acid SCHEMBL462388 0.89 MCHR1 (0.40) GPR119MCHR1DPP4KCNH2DPP8
SCHEMBL170490 0.88 GPR119 (0.42) GPR119MCHR1DPP4KCNH2DPP8
SCHEMBL122254 0.88 GPR119 (0.42) GPR119MCHR1DPP4KCNH2DPP8
SCHEMBL120013 0.87 GPR119 (0.42) GPR119MCHR1DPP4

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-2406251-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS Prosidion Limited (GB) 2012-01-18 EP disclosed
WO-2010103334-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-09-16 WO disclosed