SCHEMBL7079804

SCHEMBL7079804

CC(=O)c1ccc(-c2ccccc2)c(C(=O)Nc2ccc(NC(=O)Cc3csc(NC=O)n3)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTPS1 P17812 4/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MAPT P10636 4/20 0.44
LMNA P02545 2/20 0.44
HTT P42858 2/20 0.44
SLC12A2 P55011 1/20 0.43
SLC12A5 Q9H2X9 1/20 0.43
KDM4E B2RXH2 2/20 0.42
PDE5A O76074 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL6795713 0.90 CTPS1 (0.49) CTPS1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL6796213 0.81 CTPS1 (0.49) CTPS1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL6794201 0.78 LMNA (0.56) CTPS1MEN1KMT2AMAPTLMNA
SCHEMBL6796525 0.75 MEN1 (0.49) CTPS1MEN1KMT2ACYP2D6MAPT
SCHEMBL6670037 0.73 AVPR2 (0.43) MEN1KMT2AMAPTLMNAKDM4E
SCHEMBL6668952 0.72 LMNA (0.41) MAPTLMNAHTTKDM4ESMN1; SMN2
SCHEMBL7087415 0.71 CHRNB2 (0.51) MEN1KMT2AMAPTLMNAHTT
SCHEMBL7138922 0.71 LMNA (0.61) CTPS1MEN1KMT2ACYP2D6MAPT
SCHEMBL23140029 0.71 CTPS1 (0.75) CTPS1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL6789887 0.69 LMNA (0.58) CTPS1MEN1KMT2ACYP1A2CYP3A4

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