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SCHEMBL14722672

SCHEMBL14722672

CC(C)(C)OC(=O)N[C@H]1CN(c2ncc(C(=O)N(C3CC3)C3CCN(C(=N)NO)CC3)cn2)C[C@@H]1c1cc(F)ccc1F

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 18/20 0.40
▸ NTRK1 P04629 2/20 0.38

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
SCHEMBL6128597 1.00 GPR119 (0.40) GPR119NTRK1
SCHEMBL14730229 1.00 GPR119 (0.40) GPR119NTRK1
SCHEMBL14730243 0.85 GPR119 (0.36) GPR119NTRK1
SCHEMBL459423 0.85 GPR119 (0.41) GPR119NTRK1
SCHEMBL1724455 0.84 NTRK1 (0.40) NTRK1
SCHEMBL610993 0.84 NTRK1 (0.40) NTRK1
SCHEMBL14730269 0.83 NTRK1 (0.37) GPR119NTRK1
SCHEMBL14722774 0.82 GPR119 (0.34) GPR119NTRK1
SCHEMBL14730266 0.82 GPR119 (0.36) GPR119NTRK1
SCHEMBL14722527 0.82 PDE4B (0.41) GPR119NTRK1

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