SCHEMBL8112793

SCHEMBL8112793

N/C(=N/[N+](=O)[O-])NCCC[C@@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)NCc1cc(Cl)c(N)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 18/20 0.54
▸ NPY5R Q15761 3/20 0.51
▸ NPY2R P49146 1/20 0.51
▸ NPY4R P50391 3/20 0.49
▸ NPFFR1 Q9GZQ6 2/20 0.49
▸ NPFFR2 Q9Y5X5 2/20 0.49
▸ MCHR1 Q99705 1/20 0.46

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
SCHEMBL9285714 1.00 NPY1R (0.54) NPY1RNPY5RNPY2RNPY4RNPFFR1
SCHEMBL8126577 0.91 NPY1R (0.44) NPY1RNPY5RNPY2RNPY4RNPFFR1
SCHEMBL9280771 0.91 NPY1R (0.44) NPY1RNPY5RNPY2RNPY4RNPFFR1
SCHEMBL8126994 0.90 NPY1R (0.54) NPY1RNPY5RNPY2RNPY4RNPFFR1
SCHEMBL8126824 0.89 NPY1R (0.63) NPY1RNPY5RNPY2RNPY4RNPFFR1
SCHEMBL8126777 0.89 PADI6 (0.48) NPY1RMCHR1
SCHEMBL8125951 0.89 NPY1R (0.63) NPY1RNPY5RNPY2RNPY4RNPFFR1
SCHEMBL8120506 0.87 NPY1R (0.63) NPY1RNPY5RNPY2RNPY4RNPFFR1
SCHEMBL8124254 0.86 NPY1R (0.58) NPY1RNPY5RNPY2RNPY4RNPFFR1
SCHEMBL8111886 0.86 NPY1R (0.62) NPY1RNPY5RNPY2RNPY4RNPFFR1

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
EP-0680469-B1 AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME BOEHRINGER INGELHEIM PHARMA (DE) 2000-04-26 — — EP disclosed
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