SCHEMBL6957854

SCHEMBL6957854

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

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 2/20 0.38
ACE P12821 2/20 0.36
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
RORC P51449 4/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.31
MTNR1B P49286 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP2D6 P10635 1/20 0.31
F2RL1 P55085 1/20 0.30
DRD1 P21728 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
SCHEMBL6973366 0.85 ACE (0.41) ACERORCMTNR1BKDM4E
SCHEMBL6962545 0.84 MEN1 (0.41) ACEMEN1KMT2A
SCHEMBL6972676 0.84 ACE (0.36) ACERORCMTNR1BCYP2D6F2RL1
SCHEMBL6973916 0.83 TP53 (0.41) GHSRACERORCMTNR1B
SCHEMBL6973580 0.83 ACE (0.35) ACERORCMTNR1BCYP2D6
SCHEMBL3873900 0.83 SIRT1 (0.40) GHSRACEMEN1KMT2ARORC
SCHEMBL6967751 0.82 ACE (0.35) ACERORCMTNR1BCYP2D6F2RL1
SCHEMBL6961228 0.82 MTNR1B (0.41) ACERORCMTNR1B
SCHEMBL6975153 0.82 MEN1 (0.34) ACEMEN1KMT2A
SCHEMBL6960911 0.81 ACE (0.36) ACEF2RL1

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