SCHEMBL6967926

SCHEMBL6967926

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

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
ACE P12821 3/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
CA2 P00918 4/20 0.35
CA1 P00915 3/20 0.35
TP53 P04637 2/20 0.33
F2RL1 P55085 1/20 0.33
CA7 P43166 1/20 0.30
CA14 Q9ULX7 1/20 0.30
MAPK1 P28482 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
SCHEMBL6973916 0.82 TP53 (0.41) ACETP53
SCHEMBL6962527 0.81 ACE (0.40) ACETP53F2RL1
SCHEMBL6961228 0.81 MTNR1B (0.41) ACETP53
SCHEMBL6962032 0.80 MTNR1B (0.42) ACETP53
SCHEMBL6967615 0.80 MTNR1B (0.42) ACETP53
SCHEMBL6967120 0.80 MTNR1B (0.42) ACETP53
SCHEMBL6961379 0.80 GAA (0.43) ALDH1A1ACELMNATSHRF2RL1
SCHEMBL6973366 0.79 ACE (0.41) ACETP53
SCHEMBL7627451 0.78 MEN1 (0.33) ACE
SCHEMBL6962545 0.77 MEN1 (0.41) ACELMNA

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