SCHEMBL6974481

SCHEMBL6974481

CCOC(=O)CCCC(=O)N1CCc2cc(NC(=O)c3ccccc3-c3ccc(C(F)(F)F)cc3)ccc2C1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTTP P55157 11/20 0.51
APOB P04114 9/20 0.51
KDM4E B2RXH2 2/20 0.47
SMO Q99835 1/20 0.46
GAA P10253 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL6973467 0.93 MTTP (0.55) MTTPAPOBKDM4ESMOGAA
SCHEMBL6973387 0.89 MTTP (0.56) MTTPAPOBKDM4ESMOGAA
SCHEMBL7626403 0.89 MTTP (0.54) MTTPAPOBKDM4ESMOGAA
SCHEMBL6975248 0.88 MTTP (0.52) MTTPAPOBKDM4ESMOGAA
SCHEMBL6965797 0.87 MTTP (0.58) MTTPAPOBKDM4ESMOGAA
SCHEMBL6966884 0.83 APOB (0.61) MTTPAPOBKDM4ESMOGAA
SCHEMBL6973765 0.82 APOB (0.58) MTTPAPOBKDM4ESMOGAA
SCHEMBL6974148 0.81 MTTP (0.59) MTTPAPOBKDM4ESMOGAA
SCHEMBL8213608 0.81 MTTP (0.60) MTTPAPOBKDM4ESMOGAA
SCHEMBL6962881 0.81 MTTP (0.54) MTTPAPOBKDM4ESMOGAA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832069-B1 BIPHENYL-2-CARBOXYLIC ACID-TETRAHYDRO-ISOQUINOLIN-6-YL AMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN AND/OR APOLIPOPROTEIN B (Apo B) SECRETION PFIZER (US) 2003-03-05 EP disclosed
EP-1181954-A2 Biphenyl-2-carboxylic acid-tetrahydro-isoquinolin-6-yl amide derivatives, their preparation and use as inhibitors of microsomal triglyceride transfer protein and/or apolipoprotein B (ApoB) secretion PFIZER INC. (US) 2002-02-27 EP disclosed
US-5919795-A ATHEROSCLEROSIS THERAPY PFIZER INC. (US) 1999-07-06 US disclosed
WO-1996040640-A1 BIPHENYL-2-CARBOXYLIC ACID-TETRAHYDRO-ISOQUINOLIN-6-YL AMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN AND/OR APOLIPOPROTEIN B (Apo B) SECRETION PFIZER INC. (US) 1996-12-19 WO disclosed