SCHEMBL31420009

SCHEMBL31420009

C[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GNPAT O15228 1/20 0.56
NPY4R P50391 15/20 0.55
NPY1R P25929 9/20 0.55
NPY5R Q15761 8/20 0.55
NPY2R P49146 5/20 0.55
FNTA P49354 2/20 0.48
FNTB P49356 2/20 0.48
PGGT1B P53609 2/20 0.48

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
SCHEMBL31184322 0.96 NPY4R (0.55) GNPATNPY4RNPY1RNPY5RNPY2R
SCHEMBL31184376 0.96 NPY4R (0.55) GNPATNPY4RNPY1RNPY5RNPY2R
SCHEMBL5598820 0.96 NPY4R (0.55) GNPATNPY4RNPY1RNPY5RNPY2R
SCHEMBL5598812 0.96 NPY4R (0.55) GNPATNPY4RNPY1RNPY5RNPY2R
SCHEMBL4589880 0.95 NPY4R (0.55) GNPATNPY4RNPY1RNPY5RNPY2R
SCHEMBL2815459 0.95 NPY4R (0.55) GNPATNPY4RNPY1RNPY5RNPY2R
SCHEMBL30265523 0.93 NPY4R (0.54) GNPATNPY4RNPY1RNPY5RNPY2R
SCHEMBL30866924 0.93 NPY4R (0.56) GNPATNPY4RNPY1RNPY5RNPY2R
SCHEMBL30264923 0.93 NPY4R (0.54) GNPATNPY4RNPY1RNPY5RNPY2R
SCHEMBL24059390 0.93 NPY4R (0.55) GNPATNPY4RNPY1RNPY5RNPY2R

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-119619358-A Metabolic marker for detecting novel coronavirus combined with Epstein-Barr virus infection and application thereof 湖北医药学院附属襄阳市第一人民医院 2025-03-14 CN disclosed