SCHEMBL30570979

SCHEMBL30570979

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

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 4/20 0.57
NPY1R P25929 3/20 0.57
NPY2R P49146 3/20 0.57
BACE1 P56817 13/20 0.56
BACE2 Q9Y5Z0 4/20 0.56
CTSD P07339 1/20 0.52
OPRD1 P41143 1/20 0.52
NTSR2 O95665 1/20 0.52
NTSR1 P30989 1/20 0.52
NPY5R Q15761 2/20 0.51

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
SCHEMBL30570969 0.94 OPRD1 (0.56) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL7753372 0.92 BACE1 (0.55) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL30433598 0.91 NPY4R (0.59) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL29611460 0.90 NPY4R (0.54) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL29611583 0.89 NPY1R (0.52) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL30799753 0.89 NPY4R (0.66) NPY4RNPY1RNPY2RNTSR2NTSR1
SCHEMBL30512850 0.89 BACE1 (0.67) BACE1BACE2CTSD
SCHEMBL31472560 0.89 NPY4R (0.57) NPY4RNPY1RNPY2RBACE1BACE2
SCHEMBL29798264 0.89 BACE1 (0.64) BACE1BACE2CTSD
SCHEMBL32665677 0.89 TFPI (0.53) NPY4RNPY1RNPY2RBACE1BACE2

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-116589528-A Lumbricus guangdong characteristic peptide and application thereof 江阴天江药业有限公司 2023-08-15 CN disclosed