SCHEMBL6967751

SCHEMBL6967751

CC(Cl)CC(=O)N1CCc2c[c]ccc2C1C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACE P12821 4/20 0.35
MTNR1B P49286 2/20 0.32
RORC P51449 1/20 0.32
DRD1 P21728 1/20 0.31
F2RL1 P55085 1/20 0.31
CYP2D6 P10635 5/20 0.31
HHAT Q5VTY9 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
DPP4 P27487 1/20 0.31
DPP8 Q6V1X1 1/20 0.31

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
SCHEMBL6972676 0.91 ACE (0.36) ACEMTNR1BRORCF2RL1CYP2D6
SCHEMBL6973580 0.90 ACE (0.35) ACEMTNR1BRORCCYP2D6DPP4
SCHEMBL6965436 0.88 ACE (0.36) ACEMTNR1BRORCF2RL1CYP2D6
SCHEMBL6974568 0.85 ACE (0.39) ACEF2RL1
SCHEMBL6961368 0.83 ACE (0.35) ACEMTNR1BF2RL1CYP2D6HHAT
SCHEMBL6973366 0.83 ACE (0.41) ACEMTNR1BRORC
SCHEMBL6962527 0.82 ACE (0.40) ACEMTNR1BF2RL1
SCHEMBL6957854 0.82 GHSR (0.38) ACEMTNR1BRORCDRD1F2RL1
SCHEMBL6973916 0.81 TP53 (0.41) ACEMTNR1BRORC
SCHEMBL6961352 0.81 ACE (0.40) ACEMTNR1BRORCF2RL1NPSR1

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