SCHEMBL14722774

SCHEMBL14722774

COC(C)(C)c1nc(N2CCC(N(C(=O)c3cnc(N4C[C@H](NC(=O)OC(C)(C)C)[C@@H](c5cc(F)ccc5F)C4)nc3)C3CC3)CC2)no1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.34
NTRK1 P04629 3/20 0.34
HDAC4 P56524 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
NR1H2 P55055 1/20 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
SCHEMBL14722778 0.88 NR1H2 (0.34) GPR119NTRK1NR1H2EIF2AK4
SCHEMBL14730243 0.84 GPR119 (0.36) GPR119NTRK1
SCHEMBL14730179 0.83 GPR119 (0.34) GPR119NTRK1NR1H2
SCHEMBL14730227 0.83 NTRK1 (0.34) GPR119NTRK1NR1H2
SCHEMBL14730229 0.82 GPR119 (0.40) GPR119NTRK1
SCHEMBL14722672 0.82 GPR119 (0.40) GPR119NTRK1
SCHEMBL6128597 0.82 GPR119 (0.40) GPR119NTRK1
SCHEMBL14730202 0.80 NTRK1 (0.35) GPR119NTRK1HDAC4HDAC6NR1H2
SCHEMBL14730362 0.80 DPP4 (0.36)
SCHEMBL14722777 0.80 GPR119 (0.34) GPR119

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-2013026587-A1 1,4 DISUBSTITUTED PYRROLIDINE - 3 - YL -AMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2013-02-28 WO disclosed