SCHEMBL7083387

SCHEMBL7083387

O=C(Nc1ccc(NCCc2ccccn2)c(Cl)c1)c1cc(C(F)(F)F)ccc1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMO Q99835 2/20 0.49
RXFP1 Q9HBX9 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
GRM4 Q14833 6/20 0.45
SORT1 Q99523 1/20 0.44
NR3C1 P04150 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
SCHEMBL6795353 0.91 SMO (0.60) SMOALDH1A1LMNAMAPTGRM4
SCHEMBL7084308 0.90 SMO (0.49) SMORXFP1ALDH1A1MEN1LMNA
SCHEMBL6639807 0.90 SMO (0.49) SMORXFP1ALDH1A1MEN1LMNA
SCHEMBL7079800 0.87 ALDH1A1 (0.47) SMORXFP1ALDH1A1MEN1LMNA
SCHEMBL6641308 0.87 PKM (0.51) SMORXFP1ALDH1A1MEN1LMNA
SCHEMBL7083654 0.85 SORT1 (0.45) SMORXFP1ALDH1A1MEN1LMNA
SCHEMBL6644487 0.85 SMO (0.48) SMORXFP1ALDH1A1MEN1LMNA
SCHEMBL6492656 0.83 SMO (0.53) SMOHPGDNR3C1
SCHEMBL6643055 0.82 SMO (0.46) SMORXFP1ALDH1A1MEN1LMNA
SCHEMBL6638865 0.81 SMO (0.53) SMORXFP1ALDH1A1LMNAHTT

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