SCHEMBL31603949

SCHEMBL31603949

CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 18/20 0.64
▸ CTSD P07339 2/20 0.59
▸ NPY1R P25929 1/20 0.55
▸ NPY2R P49146 1/20 0.55
▸ NPY4R P50391 1/20 0.55
▸ BACE2 Q9Y5Z0 2/20 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
SCHEMBL30019046 0.94 BACE1 (0.64) BACE1CTSDBACE2
SCHEMBL31603931 0.92 BACE1 (0.73) BACE1CTSDBACE2
SCHEMBL31730257 0.92 BACE1 (0.61) BACE1CTSD
SCHEMBL31134058 0.92 NPY4R (0.61) BACE1CTSDNPY1RNPY2RNPY4R
SCHEMBL29777765 0.92 BACE1 (0.59) BACE1CTSDBACE2
SCHEMBL32664291 0.92 NPY4R (0.65) BACE1CTSDNPY1RNPY2RNPY4R
SCHEMBL31182633 0.91 NPY4R (0.60) BACE1NPY1RNPY2RNPY4R
SCHEMBL30769588 0.90 BACE1 (0.59) BACE1CTSDBACE2
SCHEMBL31484077 0.90 BACE1 (0.58) BACE1CTSDBACE2
SCHEMBL30686814 0.89 BACE1 (0.53) BACE1CTSDBACE2

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-120058871-A Salty peptides, compositions and uses thereof 陕西科技大学 2025-05-30 — — CN disclosed
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