SCHEMBL28013446

SCHEMBL28013446

CSCC[C@H](N)C(=O)OC(=O)CC(C)O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.40
METAP1 P53582 1/20 0.40
MARS1 P56192 10/20 0.36
BHMT Q93088 2/20 0.34
RNPEP Q9H4A4 1/20 0.33
BHMT2 Q9H2M3 1/20 0.33
ANPEP P15144 1/20 0.32
ENPEP Q07075 1/20 0.32

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
SCHEMBL108278 0.87 METAP2 (0.35) METAP2METAP1MARS1BHMTRNPEP
Hydrochloric Acid SCHEMBL8954857 0.85 METAP2 (0.35) METAP2METAP1MARS1BHMTRNPEP
SCHEMBL2876009 0.84 BHMT (0.41) BHMTRNPEPBHMT2
SCHEMBL542056 0.83 RNPEP (0.37) METAP2METAP1MARS1BHMTRNPEP
SCHEMBL16513337 0.83 METAP2 (0.40) METAP2METAP1MARS1BHMTRNPEP
SCHEMBL162031 0.82 RNPEP (0.42) METAP2METAP1MARS1BHMTRNPEP
SCHEMBL6045793 0.82 RNPEP (0.42) METAP2METAP1MARS1BHMTRNPEP
SCHEMBL20996747 0.82 RNPEP (0.42) METAP2METAP1MARS1BHMTRNPEP
SCHEMBL5617582 0.82 RNPEP (0.42) METAP2METAP1MARS1BHMTRNPEP
SCHEMBL5193805 0.81 METAP2 (0.42) METAP2METAP1MARS1BHMTRNPEP

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-104592379-A Method and reagent for detecting protein lysine-3-hydroxybutyrylation JINGJIE PTM BIOLAB HANGZHOU CO LTD 2015-05-06 CN disclosed