SCHEMBL27846680

SCHEMBL27846680

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

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 12/20 0.42
▸ NPY1R P25929 8/20 0.42
▸ NPY5R Q15761 8/20 0.37
▸ NPY2R P49146 5/20 0.37
▸ FOLH1 Q04609 1/20 0.36
▸ ERAP1 Q9NZ08 1/20 0.36
▸ LNPEP Q9UIQ6 1/20 0.36
▸ HDAC2 Q92769 1/20 0.34
▸ C3AR1 Q16581 1/20 0.34

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
SCHEMBL18465137 0.87 NPY4R (0.43) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL5807981 0.87 NPY4R (0.44) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL2390736 0.87 NPY4R (0.44) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL13950273 0.86 NPY4R (0.35) NPY4RNPY1RNPY5RNPY2RC3AR1
Hydrochloric Acid SCHEMBL11506342 0.86 NPY4R (0.44) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL9207685 0.85 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL9207694 0.85 NPY4R (0.46) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL21879809 0.84 NPY4R (0.44) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL26962723 0.82 NPY4R (0.42) NPY4RNPY1RNPY5RNPY2RFOLH1
SCHEMBL17015152 0.82 NPY4R (0.50) NPY4RNPY1RNPY5RNPY2RFOLH1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101906069-B (S)-2-substituted-(3'-acetyl-2'-pyridone-1'-yl) acetic acid as well as preparation method and application thereof UNIV CAPITAL MEDICAL 2012-12-12 — — CN disclosed
CN-101906069-A (S)-2-substituted-(3'-acetyl-2'-pyridone-1'-yl) acetic acid as well as preparation method and application thereof UNIV CAPITAL MEDICAL 2010-12-08 — — CN disclosed
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