SCHEMBL7083523

SCHEMBL7083523

CC(=O)Nc1nc(C(C)Oc2ccc([N+](=O)[O-])cc2)cs1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.59
LMNA P02545 2/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
CSNK2A2 P19784 1/20 0.46
CSNK2B P67870 1/20 0.46
CSNK2A1 P68400 1/20 0.46
MAPT P10636 5/20 0.46
HTT P42858 2/20 0.46
NPC1 O15118 1/20 0.46
DYRK1A Q13627 1/20 0.45
HTR2A P28223 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 1/20 0.42
ALDH1A1 P00352 2/20 0.42
POLB P06746 1/20 0.42
HSP90AA1 P07900 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
SCHEMBL7080473 0.83 NPC1 (0.43) RAB9ALMNAMEN1KMT2AMAPT
SCHEMBL9845157 0.79 RAB9A (0.61) RAB9ALMNAMEN1KMT2ACSNK2A2
SCHEMBL6799338 0.76 RAB9A (0.70) RAB9ALMNAMEN1KMT2AMAPT
SCHEMBL4295980 0.75 L3MBTL1 (0.51) RAB9ALMNAMEN1KMT2AMAPT
SCHEMBL9621679 0.74 RAB9A (1.00) RAB9ALMNAMEN1KMT2ACSNK2A2
SCHEMBL7083520 0.74 MAPT (0.58) RAB9ALMNAMEN1KMT2ACSNK2A2
SCHEMBL21382353 0.74 RAB9A (0.64) RAB9ALMNAMEN1KMT2ACSNK2A2
SCHEMBL13409103 0.71 RAB9A (0.64) RAB9ALMNAMEN1KMT2ACSNK2A2
SCHEMBL12190585 0.71 L3MBTL1 (0.57) RAB9ALMNAKMT2ACSNK2A2CSNK2B
SCHEMBL8934604 0.71 RAB9A (0.62) RAB9ALMNAMEN1KMT2ACSNK2A2

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