SCHEMBL7086746

SCHEMBL7086746

COc1ccc(-c2ccccc2)c(C(=O)Nc2ccc(CCc3cccc(NC(C)=O)n3)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.51
POLB P06746 1/20 0.51
KDM4E B2RXH2 3/20 0.48
CYP3A4 P08684 1/20 0.47
TACR3 P29371 1/20 0.46
PLA2G2A P14555 1/20 0.45
NR1H4 Q96RI1 1/20 0.45
ABCG2 Q9UNQ0 2/20 0.44
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
ADORA3 P0DMS8 3/20 0.43
ADORA2B P29275 2/20 0.43

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
SCHEMBL6793400 0.89 POLB (0.58) GAAPOLBKDM4ECYP3A4NR1H4
SCHEMBL7079740 0.80 SORT1 (0.43) MEN1KMT2AMAPTCA12CA1
SCHEMBL6793979 0.77 MTTP (0.53) KDM4ESMN1; SMN2ADORA3LMNA
SCHEMBL6789281 0.77 GAA (0.59) GAAPOLBKDM4ECYP3A4NR1H4
SCHEMBL7080710 0.76 SORT1 (0.43) KDM4EMEN1KMT2AMAPTCA12
SCHEMBL7079735 0.74 SORT1 (0.42) MEN1KMT2AMAPTCA12CA1
SCHEMBL6502751 0.73 CHRNB2 (0.44) CYP3A4KMT2A
SCHEMBL6488352 0.73 SMO (0.45) ADORA3BRAF
SCHEMBL6498569 0.72 ALOX15 (0.44) KDM4ECYP3A4KMT2ASMN1; SMN2MAPT
SCHEMBL6788348 0.72 MTTP (0.51) KDM4ESMN1; SMN2

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-1326835-A1 BENZAMIDE COMPOUNDS AS APO B SECRETION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-07-16 EP disclosed
WO-2002028835-A1 BENZAMIDE COMPOUNDS AS APO B SECRETION INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-04-11 WO disclosed