SCHEMBL6973580

SCHEMBL6973580

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

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACE P12821 4/20 0.35
CYP2D6 P10635 10/20 0.35
MTNR1B P49286 1/20 0.34
RORC P51449 2/20 0.33
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33

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 0.92 ACE (0.36) ACECYP2D6MTNR1BRORC
SCHEMBL6967751 0.90 ACE (0.35) ACECYP2D6MTNR1BRORCDPP4
SCHEMBL6965436 0.89 ACE (0.36) ACECYP2D6MTNR1BRORCDPP4
SCHEMBL6961368 0.84 ACE (0.35) ACECYP2D6MTNR1B
SCHEMBL6973366 0.84 ACE (0.41) ACEMTNR1BRORC
SCHEMBL6962527 0.83 ACE (0.40) ACEMTNR1B
SCHEMBL6957854 0.83 GHSR (0.38) ACECYP2D6MTNR1BRORC
SCHEMBL6973916 0.82 TP53 (0.41) ACEMTNR1BRORC
SCHEMBL3873900 0.82 SIRT1 (0.40) ACEMTNR1BRORC
SCHEMBL6974568 0.81 ACE (0.39) ACE

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