SCHEMBL7384394

SCHEMBL7384394

CCOC(=O)C(CCc1ccc(NC(=O)OC(C)(C)C)nc1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.42
GRIN2B Q13224 1/20 0.42
HDAC1 Q13547 1/20 0.42
MKNK2 Q9HBH9 1/20 0.38
PPARG P37231 2/20 0.38
PPARA Q07869 1/20 0.38
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
SCN9A Q15858 1/20 0.36
CYP17A1 P05093 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
BCL2 P10415 1/20 0.35
GSK3B P49841 1/20 0.35
DYRK1A Q13627 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
MAPKAPK2 P49137 1/20 0.35
NPR3 P17342 1/20 0.35

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
SCHEMBL7375395 0.96 NAMPT (0.43) NAMPTGRIN2BHDAC1MKNK2CTSS
SCHEMBL7384054 0.94 GRIN2B (0.42) NAMPTGRIN2BHDAC1MKNK2PPARG
SCHEMBL7375295 0.89 NAMPT (0.42) NAMPTGRIN2BHDAC1MKNK2KDM4E
SCHEMBL6059170 0.89 NAMPT (0.43) NAMPTGRIN2BHDAC1MKNK2PPARG
SCHEMBL6058751 0.86 NAMPT (0.44) NAMPTGRIN2BHDAC1MKNK2PPARG
SCHEMBL6059029 0.84 NAMPT (0.40) NAMPTGRIN2BHDAC1MKNK2PPARG
SCHEMBL7379372 0.82 NAMPT (0.41) NAMPTGRIN2BHDAC1MKNK2PPARG
SCHEMBL5076532 0.81 NAMPT (0.47) NAMPTGRIN2BHDAC1PPARGPPARA
SCHEMBL5076560 0.81 GRIN2B (0.42) NAMPTGRIN2BHDAC1CTSSCTSK
SCHEMBL7260124 0.80 NAMPT (0.44) NAMPTGRIN2BHDAC1MKNK2PPARG

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
EP-1180098-A1 NEW COMPOUNDS AstraZeneca AB (SE) 2002-02-20 EP disclosed
WO-2000066557-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 2000-11-09 WO disclosed