SCHEMBL5499951

SCHEMBL5499951

CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](CC(C)C)NC(=O)C(N)Cc1ccc(O)cc1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 11/20 0.58
NPY1R P25929 6/20 0.58
NPY2R P49146 4/20 0.58
NPY5R Q15761 4/20 0.58
NMUR2 Q9GZQ4 2/20 0.55
NMUR1 Q9HB89 2/20 0.55
NTSR2 O95665 3/20 0.54
NTSR1 P30989 3/20 0.54
SORT1 Q99523 2/20 0.54

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
SCHEMBL30943512 0.91 NTSR2 (0.56) NPY4RNPY1RNPY2RNPY5RNMUR2
SCHEMBL29619531 0.90 NPY4R (0.58) NPY4RNPY1RNPY2RNPY5RNMUR2
SCHEMBL10588690 0.89 NPY4R (0.61) NPY4RNPY1RNPY2RNPY5RNMUR2
SCHEMBL31351849 0.89 NMUR2 (0.59) NPY4RNPY1RNPY2RNPY5RNMUR2
Hydrochloric Acid SCHEMBL11665303 0.89 NMUR2 (0.58) NPY4RNPY1RNPY2RNPY5RNMUR2
SCHEMBL29479234 0.89 NTSR1 (0.66) NPY4RNPY1RNPY2RNPY5RNMUR2
Hydrochloric Acid SCHEMBL11659903 0.88 NTSR1 (0.49) NPY4RNPY1RNPY2RNPY5RNMUR2
Acetic Acid SCHEMBL2193528 0.88 OPRM1 (0.47) NPY4RNPY1RNPY2RNPY5RNMUR2
Acetic Acid SCHEMBL20769309 0.88 OPRM1 (0.47) NPY4RNPY1RNPY2RNPY5RNMUR2
Acetic Acid SCHEMBL20769302 0.88 OPRM1 (0.47) NPY4RNPY1RNPY2RNPY5RNMUR2

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
US-7309689-B2 Sustained peptide-release formulation PEPTECH LIMITED (AU) 2007-12-18 US disclosed
US-6337318-B1 DRUGS FOR PEPTIDE AGONIST PEPTECH, LTD. (AU) 2002-01-08 US disclosed