SCHEMBL13448837

SCHEMBL13448837

N=C(N)NCCC[C@H](NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 15/20 0.52
▸ NPY1R P25929 9/20 0.52
▸ NPY5R Q15761 7/20 0.52
▸ NPY2R P49146 5/20 0.52
▸ KISS1R Q969F8 1/20 0.49
▸ LTA4H P09960 1/20 0.43
▸ CTSC P53634 1/20 0.43

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
SCHEMBL30437446 1.00 NPY4R (0.52) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL29531971 0.99 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL30903436 0.99 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL29658146 0.95 NPY4R (0.49) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL13449160 0.94 NPY4R (0.60) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL29540421 0.93 NPY4R (0.63) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29461973 0.93 NPY4R (0.63) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30900195 0.93 NPY4R (0.63) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL30900117 0.93 NPY4R (0.63) NPY4RNPY1RNPY5RNPY2RKISS1R
SCHEMBL31074830 0.92 NPY4R (0.54) NPY4RNPY1RNPY5RNPY2RKISS1R

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-2166018-A2 Antibody binding affinity ligands Novo Nordisk A/S (DK) 2010-03-24 — — EP disclosed
EP-1831243-B1 ANTIBODY BINDING AFFINITY LIGANDS NOVO NORDISK AS (DK) 2010-03-17 — — EP disclosed
US-20080311681-A1 Antibody Binding Affinity Ligands VERSAMATRIX A/S (DK) 2008-12-18 — — US disclosed
US-20080311681-A1 Antibody Binding Affinity Ligands VERSAMATRIX A/S (DK) 2008-12-18 — — US disclosed
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