SCHEMBL31499403

SCHEMBL31499403

N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP3 Q9NY33 5/20 0.60
CCKBR P32239 8/20 0.55
CCKAR P32238 2/20 0.55
OPRM1 P35372 1/20 0.54
CXCL8 P10145 3/20 0.53
KISS1R Q969F8 1/20 0.53

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
SCHEMBL30310835 0.92 DPP3 (0.57) DPP3CCKBRCCKAROPRM1
SCHEMBL30957019 0.91 DPP3 (0.61) DPP3OPRM1
SCHEMBL29569487 0.91 TACR1 (0.59) DPP3CCKBRCCKAROPRM1CXCL8
SCHEMBL30540269 0.90 DPP3 (0.61) DPP3CCKBRCCKAROPRM1KISS1R
SCHEMBL31746148 0.89 DPP3 (0.58) DPP3CCKBRCCKAROPRM1CXCL8
SCHEMBL30269204 0.89 DPP3 (0.57) DPP3CCKBROPRM1KISS1R
SCHEMBL31499405 0.89 KISS1R (0.59) DPP3OPRM1KISS1R
SCHEMBL30957021 0.88 DPP3 (0.59) DPP3CXCL8
SCHEMBL30310949 0.88 DPP4 (0.59) DPP3
SCHEMBL30311066 0.88 CXCL8 (0.63) DPP3CCKBROPRM1CXCL8

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