SCHEMBL31596868

SCHEMBL31596868

CSCC[C@H](NC(=O)CNC(=O)[C@@H](N)CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 5/20 0.64
▸ OPRD1 P41143 5/20 0.64
▸ BDKRB2 P30411 1/20 0.52
▸ SLC6A2 P23975 1/20 0.51
▸ OPRK1 P41145 1/20 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
SCHEMBL31596986 1.00 OPRM1 (0.64) OPRM1OPRD1BDKRB2SLC6A2OPRK1
SCHEMBL31612385 0.96 OPRM1 (0.61) OPRM1OPRD1BDKRB2OPRK1
SCHEMBL31612359 0.93 OPRM1 (0.56) OPRM1OPRD1BDKRB2
SCHEMBL30401696 0.89 BDKRB2 (0.58) OPRM1OPRD1BDKRB2OPRK1
SCHEMBL30736123 0.89 OPRM1 (0.58) OPRM1OPRD1BDKRB2SLC6A2OPRK1
SCHEMBL30736199 0.87 OPRM1 (0.57) OPRM1OPRD1BDKRB2OPRK1
SCHEMBL31717948 0.85 OPRM1 (0.56) OPRM1OPRD1BDKRB2SLC6A2OPRK1
SCHEMBL31514365 0.85 CALCR (0.55) OPRM1OPRD1
SCHEMBL11059142 0.84 OPRD1 (0.68) OPRM1OPRD1SLC6A2
SCHEMBL30412382 0.84 OPRM1 (0.54) OPRM1OPRD1BDKRB2SLC6A2

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-120058853-A Grape seed protein peptide with DPP-IV inhibitory activity and preparation method thereof 江南大学 2025-05-30 — — CN disclosed
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