SCHEMBL6975159

SCHEMBL6975159

CC(C)(CCl)C(=O)N1CCc2cc(N)ccc2C1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.55
ESR2 Q92731 6/20 0.50
ESR1 P03372 5/20 0.50
HDAC6 Q9UBN7 3/20 0.49
HDAC8 Q9BY41 3/20 0.49
RIPK1 Q13546 2/20 0.45
HSD17B3 P37058 1/20 0.42
MMP8 P22894 1/20 0.42
NOTUM Q6P988 1/20 0.38
NAMPT P43490 1/20 0.38
ABHD6 Q9BV23 1/20 0.37

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
SCHEMBL7627454 0.86 NR1H2 (0.54) NR1H2ESR2ESR1HDAC6HDAC8
SCHEMBL6962549 0.85 HDAC6 (0.65) NR1H2ESR2ESR1HDAC6HDAC8
SCHEMBL8470192 0.85 HDAC6 (0.56) ESR2ESR1HDAC6HDAC8RIPK1
SCHEMBL4179872 0.80 ESR2 (0.72) NR1H2ESR2ESR1HDAC6HDAC8
SCHEMBL6957857 0.79 NR1H2 (0.57) NR1H2ESR2ESR1HDAC6HDAC8
SCHEMBL3858227 0.78 NOTUM (0.63) NR1H2ESR2ESR1HDAC6HDAC8
SCHEMBL29377835 0.76 NR1H2 (0.90) NR1H2ESR2ESR1HDAC6HDAC8
SCHEMBL61143 0.76 NR1H2 (0.90) NR1H2ESR2ESR1HDAC6HDAC8
SCHEMBL6961357 0.76 HPGD (0.49) NR1H2ESR2ESR1HDAC8HSD17B3
SCHEMBL381428 0.76 NR1H2 (0.56) NR1H2ESR2ESR1HDAC6HDAC8

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 5 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
US-5919795-A ATHEROSCLEROSIS THERAPY PFIZER INC. (US) 1999-07-06 US 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