SCHEMBL6974443

SCHEMBL6974443

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

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACE P12821 4/20 0.38
TP53 P04637 2/20 0.38
F2RL1 P55085 1/20 0.35
XIAP P98170 1/20 0.32
CYP2D6 P10635 1/20 0.31
MTNR1B P49286 2/20 0.31
HHAT Q5VTY9 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL6967926 0.92 ALDH1A1 (0.39) ACETP53F2RL1
SCHEMBL6962527 0.87 ACE (0.40) ACETP53F2RL1XIAPMTNR1B
SCHEMBL6961379 0.85 GAA (0.43) ACEF2RL1MTNR1B
SCHEMBL6974568 0.85 ACE (0.39) ACEF2RL1XIAP
SCHEMBL3873900 0.83 SIRT1 (0.40) ACEF2RL1MTNR1BHHATMEN1
SCHEMBL6973366 0.82 ACE (0.41) ACETP53MTNR1B
SCHEMBL6972676 0.81 ACE (0.36) ACEF2RL1CYP2D6MTNR1BHHAT
SCHEMBL6961368 0.81 ACE (0.35) ACEF2RL1CYP2D6MTNR1BHHAT
SCHEMBL6974862 0.81 ACE (0.40) ACEF2RL1MTNR1BMEN1KMT2A
SCHEMBL6973580 0.81 ACE (0.35) ACECYP2D6MTNR1B

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