SCHEMBL6974504

SCHEMBL6974504

CCn1c2ccccc2c2cc(CN3CCc4cc(N)ccc4C3)ccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 8/20 0.57
MAPT P10636 7/20 0.57
KDM4E B2RXH2 3/20 0.56
ALDH1A1 P00352 2/20 0.56
MEN1 O00255 1/20 0.56
HPGD P15428 1/20 0.56
MAPK1 P28482 1/20 0.56
HTT P42858 1/20 0.56
HBB P68871 1/20 0.56
KMT2A Q03164 1/20 0.56
HSD17B10 Q99714 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.53
THRB P10828 1/20 0.53
GAA P10253 1/20 0.52
MCHR2 Q969V1 6/20 0.51
MCHR1 Q99705 1/20 0.51
LMNA P02545 2/20 0.50
CNR2 P34972 1/20 0.49
FAAH O00519 1/20 0.48

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
SCHEMBL9987715 0.77 TP53 (0.79) TP53MAPTKDM4EALDH1A1HPGD
SCHEMBL9986187 0.76 TP53 (0.78) TP53MAPTKDM4EALDH1A1HPGD
SCHEMBL6973388 0.76 TMEM97 (0.60) MEN1KMT2A
SCHEMBL6961877 0.76 KMT2A (0.51) MAPTKDM4EALDH1A1MEN1HTT
SCHEMBL29357684 0.74 MAPT (1.00) TP53MAPTKDM4EALDH1A1MEN1
SCHEMBL37700 0.74 MAPT (1.00) TP53MAPTKDM4EALDH1A1MEN1
SCHEMBL6966743 0.74 TMEM97 (0.58) MEN1KMT2A
SCHEMBL12283590 0.73 MAPT (0.61) TP53MAPTKDM4EALDH1A1MEN1
SCHEMBL6970868 0.73 ALDH1A1 (0.76) ALDH1A1MEN1KMT2ASMN1; SMN2LMNA
SCHEMBL9986621 0.73 TP53 (0.73) TP53MAPTKDM4EALDH1A1MEN1

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 3 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
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