SCHEMBL6962032

SCHEMBL6962032

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

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 2/20 0.42
ACE P12821 1/20 0.38
TP53 P04637 1/20 0.38
GNAI3 P08754 4/20 0.36
GNAI1 P63096 4/20 0.36
GNAO1 P09471 3/20 0.36
RORC P51449 2/20 0.35
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
MAPT P10636 1/20 0.34
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
NAAA Q02083 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
SCHEMBL6970287 1.00 MTNR1B (0.42) MTNR1BACETP53GNAI3GNAI1
SCHEMBL6967120 1.00 MTNR1B (0.42) MTNR1BACETP53GNAI3GNAI1
SCHEMBL6967615 1.00 MTNR1B (0.42) MTNR1BACETP53GNAI3GNAI1
SCHEMBL6961228 0.99 MTNR1B (0.41) MTNR1BACETP53GNAI3GNAI1
SCHEMBL6973916 0.96 TP53 (0.41) MTNR1BACETP53RORCADRA1D
SCHEMBL6974328 0.94 KDM4E (0.39) MTNR1BACETP53
SCHEMBL6958115 0.94 KDM4E (0.39) MTNR1BACETP53
SCHEMBL6973366 0.91 ACE (0.41) MTNR1BACETP53RORC
SCHEMBL6961352 0.87 ACE (0.40) MTNR1BACETP53RORCMAPT
SCHEMBL6972676 0.81 ACE (0.36) MTNR1BACERORCMAPT

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