SCHEMBL8119920

SCHEMBL8119920

NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCN/C(N)=N\[N+](=O)[O-])NC(=O)C(c1ccccc1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 18/20 0.58
▸ NPFFR1 Q9GZQ6 2/20 0.52
▸ NPFFR2 Q9Y5X5 2/20 0.52
▸ NPY5R Q15761 2/20 0.52
▸ NPY4R P50391 1/20 0.49
▸ KISS1R Q969F8 1/20 0.48

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
SCHEMBL8119924 1.00 NPY1R (0.58) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL8124246 0.89 NPY1R (0.72) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7042397 0.88 NPY1R (0.51) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7042405 0.88 NPY1R (0.51) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL8127508 0.84 NPY4R (0.64) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7037336 0.84 NPY1R (0.51) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL7037325 0.84 NPY1R (0.51) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL8121280 0.84 NPY1R (0.51) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL8120885 0.84 NPY1R (0.55) NPY1RNPFFR1NPFFR2NPY5RNPY4R
SCHEMBL8126824 0.83 NPY1R (0.63) 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 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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