SCHEMBL31499405

SCHEMBL31499405

NC(=O)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KISS1R Q969F8 3/20 0.59
DPP3 Q9NY33 3/20 0.58
OPRM1 P35372 1/20 0.57
SLC6A2 P23975 1/20 0.55

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
SCHEMBL30269204 0.91 DPP3 (0.57) KISS1RDPP3OPRM1
SCHEMBL30540269 0.91 DPP3 (0.61) KISS1RDPP3OPRM1
SCHEMBL30827785 0.90 DPP3 (0.60) KISS1RDPP3OPRM1
SCHEMBL29426589 0.90 AGTR1 (0.60) KISS1RDPP3OPRM1SLC6A2
SCHEMBL31402666 0.89 AGTR2 (0.61) KISS1RDPP3OPRM1SLC6A2
SCHEMBL30424046 0.89 DPP3 (0.67) DPP3OPRM1SLC6A2
SCHEMBL31402672 0.89 KISS1R (0.63) KISS1RDPP3OPRM1SLC6A2
SCHEMBL31499403 0.89 DPP3 (0.60) KISS1RDPP3OPRM1
SCHEMBL31475666 0.88 CCKBR (0.54) KISS1RDPP3
SCHEMBL30033999 0.88 KISS1R (0.57) KISS1RDPP3OPRM1

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-119684404-A Boshui hickory-derived antioxidant active peptide, screening method and application thereof 浙江农林大学 2025-03-25 CN disclosed