SCHEMBL29558352

SCHEMBL29558352

C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 15/20 0.54
▸ NPY1R P25929 9/20 0.54
▸ NPY5R Q15761 8/20 0.54
▸ NPY2R P49146 5/20 0.54
▸ OPRM1 P35372 2/20 0.52
▸ OPRD1 P41143 2/20 0.52
▸ OPRK1 P41145 1/20 0.52
▸ KEAP1 Q14145 2/20 0.50

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
SCHEMBL29851196 0.92 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30590517 0.90 NPY4R (0.54) NPY4RNPY1RNPY5RNPY2ROPRM1
SCHEMBL30974443 0.88 OPRL1 (0.55) KEAP1
SCHEMBL30690149 0.88 NPY4R (0.59) NPY4RNPY1RNPY5RNPY2ROPRM1
SCHEMBL31680264 0.87 NPY4R (0.65) NPY4RNPY1RNPY5RNPY2ROPRM1
SCHEMBL6515301 0.86 NPY4R (0.59) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30474555 0.86 NPY4R (0.57) NPY4RNPY1RNPY5RNPY2ROPRM1
SCHEMBL31516389 0.86 OPRM1 (0.60) NPY4RNPY1RNPY5RNPY2ROPRM1
SCHEMBL30903451 0.86 NPY4R (0.53) NPY4RNPY1RNPY5RNPY2RKEAP1
SCHEMBL29463776 0.85 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RKEAP1

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-111606972-B Codfish skin oligopeptide, separation and purification thereof, and application of codfish skin oligopeptide in preparation of alpha-glucosidase inhibitor and anti-type II diabetes drug 浙江省医学科学院 2022-04-05 — — CN disclosed
Send feedback