SCHEMBL470640

SCHEMBL470640

CC(C)(C)OC(=O)N[C@H]1CN(c2ncc(OCC3CCN(c4noc(C(C)(F)F)n4)CC3)cn2)C[C@@H]1c1cc(F)ccc1F

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.36
NTRK1 P04629 3/20 0.35
GPR119 Q8TDV5 5/20 0.35
ACACB O00763 2/20 0.35
RBP4 P02753 2/20 0.35
TTR P02766 2/20 0.35
ACACA Q13085 1/20 0.35
KCNH2 Q12809 1/20 0.35
HDAC4 P56524 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
RET P07949 4/20 0.34
EIF2AK4 Q9P2K8 1/20 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
SCHEMBL12064977 0.91 GPR119 (0.38) MCHR1NTRK1GPR119RBP4TTR
SCHEMBL470751 0.89 GPR119 (0.38) MCHR1NTRK1GPR119RBP4TTR
SCHEMBL470485 0.88 GPR119 (0.43) MCHR1NTRK1GPR119KCNH2RET
SCHEMBL470590 0.87 NTRK1 (0.38) MCHR1NTRK1GPR119ACACBRBP4
SCHEMBL470618 0.85 MCHR1 (0.43) MCHR1GPR119ACACBRBP4TTR
SCHEMBL12064703 0.85 MCHR1 (0.37) MCHR1NTRK1GPR119KCNH2HDAC6
SCHEMBL459423 0.83 GPR119 (0.41) MCHR1NTRK1GPR119RBP4RET
SCHEMBL470475 0.83 GPR119 (0.38) GPR119ACACBKCNH2EIF2AK4
SCHEMBL12064704 0.82 GPR119 (0.36) MCHR1NTRK1GPR119ACACBRET
SCHEMBL458155 0.80 PDE4B (0.43) MCHR1GPR119

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