SCHEMBL30570977

SCHEMBL30570977

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

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 7/20 0.58
NPY1R P25929 5/20 0.58
NPY2R P49146 3/20 0.58
NPY5R Q15761 3/20 0.58
BACE1 P56817 9/20 0.58
BACE2 Q9Y5Z0 1/20 0.56
KEAP1 Q14145 1/20 0.56
KISS1R Q969F8 3/20 0.55
CTSD P07339 1/20 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
SCHEMBL30570978 0.95 KISS1R (0.56) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL30903461 0.93 NPY4R (0.55) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL30903451 0.92 NPY4R (0.53) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL30436211 0.92 BACE1 (0.61) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL29834946 0.91 NPY4R (0.65) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL29834938 0.91 NPY4R (0.65) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL31415952 0.91 NPY4R (0.58) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL30671760 0.91 BACE1 (0.56) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL29397501 0.91 BACE1 (0.53) BACE1BACE2KISS1RCTSD
SCHEMBL29875567 0.90 KISS1R (0.68) NPY4RNPY1RNPY2RNPY5RKISS1R

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