SCHEMBL7036808

SCHEMBL7036808

N=C(N)NCCC[C@@H](NC(=O)C(c1ccc(O)cc1)c1ccc(O)cc1)C(=O)NCc1ccc(CNC(N)=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 19/20 0.61
NPFFR1 Q9GZQ6 2/20 0.60
NPFFR2 Q9Y5X5 2/20 0.60
NPY5R Q15761 2/20 0.60
NPY4R P50391 3/20 0.58

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
SCHEMBL7753036 0.92 NPY1R (0.59) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL650331 0.92 NPY1R (0.72) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7037374 0.91 NPY1R (0.57) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7038160 0.91 NPY1R (0.61) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7059807 0.91 NPY1R (0.71) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL6899864 0.91 NPY1R (0.71) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7753042 0.89 NPY1R (0.70) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7040755 0.88 NPY1R (0.55) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL8119314 0.87 NPY1R (0.74) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL8525686 0.86 NPY1R (0.52) NPY1RNPFFR1NPFFR2NPY5RNPY4R

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0885186-B1 AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM THOMAE GMBH DR K (DE) 2003-03-26 EP claimed
EP-0885186-B1 AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM THOMAE GMBH DR K (DE) 2003-03-26 EP disclosed
EP-0885186-A1 AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM Dr. Karl Thomae GmbH (DE) 1998-12-23 EP disclosed
WO-1997019911-A1 AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM DR. KARL THOMAE GMBH (DE) 1997-06-05 WO disclosed