SCHEMBL7080737

SCHEMBL7080737

CC(=O)c1cccc(-c2ccccc2C(=O)Nc2ccc(NCCc3ccccn3)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
MAPT P10636 1/20 0.50
SMO Q99835 2/20 0.49
RAB9A P51151 3/20 0.47
NPC1 O15118 2/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 2/20 0.45
LMNA P02545 1/20 0.45
ALDH1A1 P00352 2/20 0.43
TP53 P04637 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ATR Q13535 1/20 0.43
F10 P00742 1/20 0.43
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
SYK P43405 1/20 0.43
IRAK4 Q9NWZ3 1/20 0.42
CHRNB2 P17787 1/20 0.42
CHRNB4 P30926 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
SCHEMBL6795959 0.89 MAPT (0.58) SMN1; SMN2MAPTSMORAB9ANPC1
SCHEMBL6795756 0.88 L3MBTL1 (0.53) SMN1; SMN2SMORAB9ANPC1HTT
SCHEMBL7086601 0.87 SMN1; SMN2 (0.53) SMN1; SMN2MAPTSMORAB9ANPC1
SCHEMBL6796673 0.87 HTT (0.59) MAPTSMORAB9ANPC1HTT
SCHEMBL6795360 0.86 CNR1 (0.50) SMN1; SMN2MAPTSMORAB9ANPC1
SCHEMBL6794256 0.86 NPC1 (0.55) MAPTSMORAB9ANPC1TSHR
SCHEMBL6799491 0.86 TAS1R3 (0.53) SMN1; SMN2MAPTSMORAB9ANPC1
SCHEMBL6793890 0.85 RAB9A (0.54) SMN1; SMN2MAPTSMORAB9ANPC1
SCHEMBL6795302 0.85 TAS1R3 (0.47) SMN1; SMN2MAPTSMORAB9ANPC1
SCHEMBL6791511 0.85 HTT (0.57) MAPTSMORAB9ANPC1HTT

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