SCHEMBL31379768

SCHEMBL31379768

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

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 12/20 0.51
NPY1R P25929 7/20 0.51
NPY2R P49146 5/20 0.51
NPY5R Q15761 5/20 0.51
BACE1 P56817 7/20 0.47
BACE2 Q9Y5Z0 1/20 0.47
KEAP1 Q14145 1/20 0.47
CTSD P07339 1/20 0.45

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
SCHEMBL31344443 1.00 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL31344448 0.96 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL30933209 0.96 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL30531638 0.96 NPY4R (0.51) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL31674373 0.95 NPY4R (0.44) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL31605454 0.95 NPY4R (0.48) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL30531634 0.94 NPY4R (0.56) NPY4RNPY1RNPY2RNPY5RBACE1
SCHEMBL31344449 0.94 NPY4R (0.52) NPY4RNPY1RNPY2RNPY5RKEAP1
SCHEMBL31097750 0.94 NPY4R (0.52) NPY4RNPY1RNPY2RNPY5RKEAP1
SCHEMBL31752429 0.93 NPY4R (0.57) NPY4RNPY1RNPY2RNPY5RBACE1

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
WO-2025027182-A1 AGENTS AND METHODS FOR TARGETED DELIVERY TO CELLS BioNTech SE (DE) 2025-02-06 WO disclosed