SCHEMBL8975469

SCHEMBL8975469

N=C(N)NCCC[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 16/20 0.73
NPY1R P25929 10/20 0.73
NPY5R Q15761 9/20 0.73
NPY2R P49146 6/20 0.73

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
SCHEMBL29483774 1.00 NPY4R (0.73) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29641108 0.98 NPY4R (0.76) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29641194 0.98 NPY4R (0.76) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29641115 0.98 NPY4R (0.76) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29641126 0.98 NPY4R (0.76) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29641019 0.98 NPY4R (0.76) NPY4RNPY1RNPY5RNPY2R
SCHEMBL26179144 0.98 NPY4R (0.76) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29641098 0.96 NPY4R (0.68) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29641056 0.96 NPY4R (0.68) NPY4RNPY1RNPY5RNPY2R
SCHEMBL8975803 0.96 NPY4R (0.68) NPY4RNPY1RNPY5RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0350221-B1 Dermorphin analogs, their methods of preparation, pharmaceutical compositions, and methods of therapeutic treatment using the same ASTRA AB (SE) 1996-04-17 EP disclosed
EP-0350221-A2 Dermorphin analogs, their methods of preparation, pharmaceutical compositions, and methods of therapeutic treatment using the same Astra Aktiebolag (SE) 1990-01-10 EP disclosed