SCHEMBL6231398

SCHEMBL6231398

CC(C)(C)OC(=O)N(CC(=O)O)CC(=O)c1ccc2ccccc2n1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
KDM4E B2RXH2 3/20 0.43
KDM4C Q9H3R0 1/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
CNR2 P34972 4/20 0.42
ALDH1A1 P00352 3/20 0.41
GAA P10253 2/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 1/20 0.41
NFKB1 P19838 1/20 0.39
RAB9A P51151 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL6227192 0.80 EGLN1 (0.41) L3MBTL1HDAC1
SCHEMBL6226886 0.78 NPC1 (0.51) SMN1; SMN2KMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL6353530 0.77 NCF1 (0.42) MGAMSMN1; SMN2KDM4EKDM4CKMT2A
SCHEMBL6231884 0.76 KDM4E (0.47) SMN1; SMN2KDM4EKMT2AMEN1L3MBTL1
SCHEMBL5070882 0.76 ALDH1A1 (0.51) MGAMSMN1; SMN2KDM4EKDM4CKMT2A
SCHEMBL4312684 0.73 MGAM (0.56) MGAMSMN1; SMN2KDM4EKMT2AMEN1
SCHEMBL78691 0.72 CA14 (0.41) KDM4EKMT2AMEN1L3MBTL1GAA
SCHEMBL3050230 0.71 MEN1 (0.46) SMN1; SMN2KDM4EKMT2AMEN1L3MBTL1
SCHEMBL2834319 0.71 HDAC3 (0.55) L3MBTL1ALDH1A1HDAC1
SCHEMBL7660084 0.71 MGAM (0.53) MGAMSMN1; SMN2KDM4EKMT2ACNR2

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
EP-1595866-A1 COMPOUND INHIBITING DIPEPTIDYL PEPTIDASE IV Sanwa Kagaku Kenkyusho Co., Ltd. (JP) 2005-11-16 EP disclosed