SCHEMBL8526322

SCHEMBL8526322

NCCC[C@H](NC(=O)C(c1ccccc1)c1ccccc1)C(=O)OC(N)=N[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 17/20 0.44
▸ NPY5R Q15761 5/20 0.44
▸ NPY4R P50391 2/20 0.42
▸ NPFFR1 Q9GZQ6 2/20 0.41
▸ NPFFR2 Q9Y5X5 2/20 0.41
▸ NPY2R P49146 1/20 0.40
▸ MCHR1 Q99705 1/20 0.39

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
SCHEMBL8586110 0.89 NPY1R (0.41) NPY1RNPY5RNPY4RNPFFR1NPFFR2
SCHEMBL8526218 0.83 NPY1R (0.48) NPY1RNPY5RNPY4RNPFFR1NPFFR2
SCHEMBL8120862 0.77 NPY1R (0.54) NPY1RNPY5RNPY4RNPFFR1NPFFR2
SCHEMBL8526459 0.77 NPY1R (0.54) NPY1RNPY5RNPY4RNPFFR1NPFFR2
SCHEMBL8526425 0.76 TGM2 (0.47) —
SCHEMBL7597314 0.75 NPY1R (0.52) NPY1RNPY5RNPY4RNPFFR1NPFFR2
SCHEMBL7597310 0.75 NPY1R (0.52) NPY1RNPY5RNPY4RNPFFR1NPFFR2
SCHEMBL8121995 0.75 NPY1R (0.52) NPY1RNPY5RNPY4RNPFFR1NPFFR2
SCHEMBL7037325 0.74 NPY1R (0.51) NPY1RNPY5RNPY4RNPFFR1NPFFR2
SCHEMBL7042405 0.74 NPY1R (0.51) NPY1RNPY5RNPY4RNPFFR1NPFFR2

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-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
EP-0680469-A1 AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME Dr. Karl Thomae GmbH (DE) 1995-11-08 — — EP disclosed
WO-1994017035-A1 AMINOACID DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND PROCESS FOR PREPARING THE SAME DR. KARL THOMAE GMBH (DE) 1994-08-04 — — WO disclosed
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