SCHEMBL6974445

SCHEMBL6974445

CCC(CC)C(=O)N1CCc2cc(N)ccc2C1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.51
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ACE P12821 2/20 0.45
NAMPT P43490 2/20 0.44
HSD17B3 P37058 1/20 0.44
HDAC8 Q9BY41 3/20 0.43
DPP8 Q6V1X1 8/20 0.42
DPP7 Q9UHL4 7/20 0.42
DPP9 Q86TI2 6/20 0.42
DPP4 P27487 2/20 0.41

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
SCHEMBL6967929 0.90 NR1H2 (0.48) NR1H2KDM4EALDH1A1TSHRHSD17B10
SCHEMBL6962531 0.85 NR1H2 (0.54) NR1H2ACENAMPTHSD17B3HDAC8
SCHEMBL6961381 0.84 ALDH1A1 (0.68) NR1H2KDM4EALDH1A1TSHRHSD17B10
SCHEMBL6974571 0.82 NR1H2 (0.52) NR1H2ACEHSD17B3HDAC8DPP8
SCHEMBL3858227 0.80 NOTUM (0.63) NR1H2HSD17B3HDAC8
SCHEMBL6973945 0.80 NR1H2 (0.52) NR1H2KDM4EALDH1A1TSHRHSD17B10
SCHEMBL6972682 0.78 NR1H2 (0.51) NR1H2KDM4EACENAMPTHSD17B3
SCHEMBL6973919 0.78 NR1H2 (0.51) NR1H2KDM4EALDH1A1TSHRHSD17B10
SCHEMBL381428 0.78 NR1H2 (0.56) NR1H2HSD17B3HDAC8
SCHEMBL6961235 0.77 SGPL1 (0.51) NR1H2KDM4EALDH1A1TSHRHSD17B10

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
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