SCHEMBL7134201

SCHEMBL7134201

O=C(Nc1ccc(C(O)CCc2cccnc2)cc1)c1cc(C(F)(F)F)ccc1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 3/20 0.51
ADRB1 P08588 5/20 0.50
ADRB3 P13945 5/20 0.50
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
XBP1 P17861 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SORT1 Q99523 1/20 0.46
CYP11B1 P15538 2/20 0.44
CYP11B2 P19099 2/20 0.44
ADRB2 P07550 4/20 0.44
HIF1A Q16665 2/20 0.44
EPAS1 Q99814 2/20 0.44
SRPK3 Q9UPE1 1/20 0.43
EPHX2 P34913 2/20 0.43
PTAFR P25105 2/20 0.43
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL6792412 0.90 ADRB3 (0.54) ADRB1ADRB3LMNAMAPTXBP1
SCHEMBL7084233 0.80 SORT1 (0.45) SORT1
SCHEMBL7079735 0.79 SORT1 (0.42) MAPTSORT1KMT2A
SCHEMBL7079790 0.76 S1PR1 (0.51) LMNASMN1; SMN2HIF1AEPAS1
SCHEMBL6800223 0.75 ADRB1 (0.53) LRRK2ADRB1ADRB3LMNAMAPT
SCHEMBL6798640 0.75 HIF1A (0.53) LRRK2ADRB1ADRB3LMNAMAPT
SCHEMBL6793989 0.75 TRPV1 (0.48) SMN1; SMN2SORT1
SCHEMBL7086952 0.74 PLG (0.53) LRRK2LMNASMN1; SMN2
SCHEMBL7086631 0.74 NPC1 (0.54) LMNASMN1; SMN2
SCHEMBL6666916 0.73 CYP11B1 (0.55) LRRK2SORT1CYP11B1CYP11B2HIF1A

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