SCHEMBL30570978

SCHEMBL30570978

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

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KISS1R Q969F8 4/20 0.56
BACE1 P56817 3/20 0.54
NPY4R P50391 6/20 0.53
NPY1R P25929 4/20 0.53
NPY2R P49146 2/20 0.53
NPY5R Q15761 2/20 0.53
KEAP1 Q14145 2/20 0.52
BACE2 Q9Y5Z0 1/20 0.52
VIPR1 P32241 1/20 0.51
VIPR2 P41587 1/20 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
SCHEMBL30570977 0.95 NPY4R (0.58) KISS1RBACE1NPY4RNPY1RNPY2R
SCHEMBL29601949 0.93 NPY4R (0.58) KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL29834946 0.93 NPY4R (0.65) KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL29834938 0.93 NPY4R (0.65) KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL29720230 0.92 NPY4R (0.61) KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL29875567 0.92 KISS1R (0.68) KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL30903461 0.92 NPY4R (0.55) BACE1NPY4RNPY1RNPY2RNPY5R
SCHEMBL29464013 0.90 NPY4R (0.55) KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL31361466 0.90 NPY4R (0.59) KISS1RBACE1NPY4RNPY1RNPY2R
SCHEMBL30671760 0.89 BACE1 (0.56) BACE1NPY4RNPY1RNPY2RNPY5R

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