SCHEMBL7084367

SCHEMBL7084367

CN(C(=O)OC(C)(C)C)c1nc(CCOC(=O)Nc2ccc(NC(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)cc2)cs1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTTP P55157 10/20 0.42
APOB P04114 7/20 0.42
SMO Q99835 1/20 0.40
TP53 P04637 4/20 0.40
MAPT P10636 2/20 0.40
UGCG Q16739 1/20 0.38
GAA P10253 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL6793408 0.91 TP53 (0.43) MTTPAPOBSMOTP53MAPT
SCHEMBL6788870 0.88 LMNA (0.51) MTTPAPOBSMOMAPTUGCG
SCHEMBL6794352 0.86 MTTP (0.41) MTTPAPOBSMOTP53MAPT
SCHEMBL7084370 0.83 MTTP (0.43) MTTPAPOBSMOTP53MAPT
SCHEMBL7085681 0.80 MTTP (0.47) MTTPAPOBSMOUGCGGAA
SCHEMBL6789164 0.78 TP53 (0.45) MTTPAPOBSMOTP53MAPT
SCHEMBL6798629 0.78 KMT2A (0.37) MTTPMAPTGAASMN1; SMN2KDM4E
SCHEMBL6795504 0.77 MTTP (0.42) MTTPAPOBSMOTP53MAPT
SCHEMBL6795017 0.75 TP53 (0.50) MTTPAPOBTP53MAPTSMN1; SMN2
SCHEMBL6799168 0.75 TP53 (0.49) MTTPAPOBSMOTP53MAPT

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