SCHEMBL30175904

SCHEMBL30175904

CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 6/20 0.58
▸ NPY4R P50391 13/20 0.57
▸ NPY1R P25929 9/20 0.57
▸ NPY5R Q15761 8/20 0.57
▸ NPY2R P49146 5/20 0.57
▸ BACE2 Q9Y5Z0 1/20 0.52

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
SCHEMBL29394453 0.96 NPY4R (0.61) BACE1NPY4RNPY1RNPY5RNPY2R
SCHEMBL29641576 0.90 NPY4R (0.56) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30477221 0.90 NPY4R (0.56) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30866943 0.90 NPY4R (0.61) BACE1NPY4RNPY1RNPY5RNPY2R
SCHEMBL30873783 0.89 NPY4R (0.60) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30175896 0.89 BACE1 (0.68) BACE1NPY4RNPY1RNPY5RNPY2R
SCHEMBL31361466 0.89 NPY4R (0.59) BACE1NPY4RNPY1RNPY5RNPY2R
SCHEMBL30310209 0.88 NPY4R (0.64) BACE1NPY4RNPY1RNPY5RNPY2R
SCHEMBL29968102 0.87 BACE1 (0.58) BACE1NPY4RNPY1RNPY5RBACE2
SCHEMBL29973314 0.87 NPY4R (0.67) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115700258-A Amygdalus pedunculatus enzymolysis peptide for preventing chronic fatigue syndrome and application thereof 西北大学 2023-02-07 — — CN disclosed
Send feedback