SCHEMBL6974860

SCHEMBL6974860

Nc1ccc2c(c1)CCN(C(=O)c1ccccn1)C2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
PDE4B Q07343 1/20 0.54
ALDH1A1 P00352 4/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NAMPT P43490 2/20 0.48
NPC1 O15118 2/20 0.48
KMT2A Q03164 2/20 0.48
RAB9A P51151 1/20 0.48
HTT P42858 1/20 0.46
SYK P43405 1/20 0.45
NR1H2 P55055 1/20 0.45
PDGFRB P09619 1/20 0.45
KDR P35968 1/20 0.45
HPGD P15428 4/20 0.44
HSD17B3 P37058 1/20 0.44
MAPT P10636 3/20 0.44
ALOX15 P16050 2/20 0.44
TSHR P16473 2/20 0.44
HSD17B10 Q99714 2/20 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
SCHEMBL8241175 0.85 GAA (0.72) GAAL3MBTL1PDE4BALDH1A1SMN1; SMN2
SCHEMBL6964823 0.81 PTK2 (0.56) GAAL3MBTL1ALDH1A1SMN1; SMN2KMT2A
SCHEMBL6969709 0.81 GRM5 (0.47) GAAALDH1A1KMT2AHTTNR1H2
SCHEMBL6972828 0.80 HPGD (0.56) PDE4BALDH1A1SMN1; SMN2NAMPTKMT2A
SCHEMBL13717628 0.80 GAA (0.55) GAAL3MBTL1PDE4BALDH1A1SMN1; SMN2
SCHEMBL6961377 0.80 KDM4E (0.53) ALDH1A1NAMPTNPC1KMT2ARAB9A
SCHEMBL6961230 0.80 TSHR (0.50) GAAL3MBTL1ALDH1A1SMN1; SMN2KMT2A
SCHEMBL6968133 0.79 MEN1 (0.62) GAAPDE4BALDH1A1SMN1; SMN2NAMPT
SCHEMBL20536804 0.78 HSD17B3 (0.52) GAAL3MBTL1PDE4BALDH1A1SMN1; SMN2
SCHEMBL20536803 0.77 NPC1 (0.50) GAAL3MBTL1PDE4BSMN1; SMN2NAMPT

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 7 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
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 claimed
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
EP-0832069-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) 1998-04-01 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