SCHEMBL7084236

SCHEMBL7084236

Nc1ccc(C(CCO)c2ccccn2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.53
SLC6A4 P31645 6/20 0.53
CHRM2 P08172 5/20 0.53
SCN1A P35498 3/20 0.53
SCN2A Q99250 3/20 0.53
SCN3A Q9NY46 3/20 0.53
SLC6A3 Q01959 5/20 0.50
CHRM1 P11229 4/20 0.50
HRH1 P35367 4/20 0.50
KCNH2 Q12809 4/20 0.50
HRH3 Q9Y5N1 4/20 0.50
ADRA2B P18089 3/20 0.50
HTR2A P28223 3/20 0.50
LMNA P02545 3/20 0.50
CYP2D6 P10635 2/20 0.50
NFKB1 P19838 2/20 0.50
THPO P40225 2/20 0.50
DRD1 P21728 2/20 0.50
HTR2C P28335 2/20 0.50
CHRM5 P08912 2/20 0.50

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
SCHEMBL9530814 0.89 SLC6A2 (0.46) SLC6A2SLC6A4CHRM2SCN1ASCN2A
SCHEMBL31374423 0.84 CHRM2 (0.69) SLC6A2SLC6A4CHRM2SCN1ASCN2A
SCHEMBL7615187 0.78 CNR2 (0.46) HRH1HTR2ATSHRHIF1AALDH1A1
SCHEMBL6681106 0.78 SLC6A2 (0.45) SLC6A2SLC6A4CHRM2SCN1ASCN2A
SCHEMBL6679213 0.77 CYP2D6 (0.48) SLC6A2SLC6A4CHRM2SCN1ASCN2A
SCHEMBL9812324 0.76 SLC6A2 (0.63) SLC6A2SLC6A4CHRM2SCN1ASCN2A
SCHEMBL5655181 0.76 SLC6A3 (0.46) SLC6A2SLC6A4SLC6A3KCNH2LMNA
SCHEMBL29088831 0.76 SLC6A3 (0.78) SLC6A2SLC6A4CHRM2SCN1ASCN2A
SCHEMBL5655372 0.76 SLC6A3 (0.46) SLC6A2SLC6A4SLC6A3KCNH2LMNA
SCHEMBL5655180 0.76 SLC6A3 (0.46) SLC6A2SLC6A4SLC6A3KCNH2LMNA

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