SCHEMBL6975568

SCHEMBL6975568

O=C(Nc1ccc2c(c1)CCN(C(=O)CC1=CCCC1)C2)c1ccccc1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MTTP P55157 14/20 0.51
APOB P04114 9/20 0.51
SMO Q99835 1/20 0.47
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 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
SCHEMBL6974345 0.87 MTTP (0.40) MTTPAPOB
SCHEMBL6974436 0.85 MTTP (0.53) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL6969388 0.85 MTTP (0.51) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL8475640 0.84 MTTP (0.39) MTTPKDM4EALDH1A1LMNA
SCHEMBL6966884 0.84 APOB (0.61) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL6965797 0.84 MTTP (0.58) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL7626403 0.82 MTTP (0.54) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL6973387 0.82 MTTP (0.56) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL6973467 0.82 MTTP (0.55) MTTPAPOBSMOKDM4EALDH1A1
SCHEMBL6973765 0.81 APOB (0.58) MTTPAPOBSMOKDM4EALDH1A1

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-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 claimed
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 claimed