SCHEMBL6550873

SCHEMBL6550873

CCc1cccc2c1C(=O)N(C(=O)O)C2=O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.49
DPP4 P27487 2/20 0.49
KDM4E B2RXH2 6/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 1/20 0.40
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
LMNA P02545 2/20 0.39
F2 P00734 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
PDK2 Q15119 1/20 0.39
CES1 P23141 1/20 0.38
ASAH1 Q13510 1/20 0.38
TYMS P04818 1/20 0.37

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
SCHEMBL13671330 0.87 AKR1B1 (0.42) ANPEPDPP4KDM4EMAPTHPGD
SCHEMBL23121513 0.84 ANPEP (0.44) ANPEPDPP4KDM4EMAPTKMT2A
SCHEMBL9496052 0.77 ALDH1A1 (0.51) KDM4EMAPTKMT2AMEN1LMNA
SCHEMBL29763759 0.77 HNF4A (0.44) KDM4EMAPTKMT2AMEN1LMNA
SCHEMBL13671328 0.77 MEN1 (0.60) ANPEPDPP4KDM4EMAPTHPGD
Malonic Acid SCHEMBL11024941 0.76 CYP1B1 (0.47) ANPEPDPP4KDM4EMAPTHPGD
SCHEMBL4538988 0.76 PTGS2 (0.39) ANPEPDPP4KDM4EMAPTKMT2A
SCHEMBL28806770 0.76 HNF4A (0.43) KDM4EMAPTKMT2AMEN1LMNA
SCHEMBL10655754 0.75 ANPEP (0.43) ANPEPDPP4KDM4EMAPTHPGD
SCHEMBL23639836 0.75 ANPEP (0.47) ANPEPDPP4KDM4EMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1483442-A2 NOVEL CATALYTIC ACTIVITIES OF OXIDOREDUCTASES FOR OXIDATION AND/OR BLEACHING Call, Krimhild (DE) 2004-12-08 EP disclosed
EP-1436371-A2 ENZYMATIC SYSTEMS FOR GENERATING ACTIVE OXYGEN SPECIES FOR REACTING WITH OTHER PRECURSORS TO OBTAIN OXIDATION AND/OR BLEACHING Call, Krimhild (DE) 2004-07-14 EP disclosed
WO-2003061550-A2 NOVEL CATALYTIC ACTIVITIES OF OXIDOREDUCTASES FOR OXIDATION AND/OR BLEACHING CALL, KRIMHILD (DE) 2003-07-31 WO disclosed
WO-2002099023-A2 ENZYMATIC SYSTEMS FOR GENERATING ACTIVE OXYGEN SPECIES FOR REACTING WITH OTHER PRECURSORS TO OBTAIN OXIDATION AND/OR BLEACHING CALL, KRIMHILD (DE) 2002-12-12 WO disclosed