SCHEMBL6969731

SCHEMBL6969731

NC(=O)C1c2cc[c]cc2CCN1C(=O)CCC1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.39
ACE P12821 1/20 0.38
F2RL1 P55085 1/20 0.38
ALDH1A1 P00352 5/20 0.37
F2 P00734 2/20 0.37
LMNA P02545 8/20 0.36
MAPT P10636 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
KMT2A Q03164 1/20 0.34
TP53 P04637 3/20 0.34
MAPK1 P28482 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HIF1A Q16665 1/20 0.34

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 0.84 ACE (0.41) ACETP53KDM4E
SCHEMBL6973916 0.82 TP53 (0.41) ACEMAPTTP53
SCHEMBL6961352 0.82 ACE (0.40) ACEF2RL1ALDH1A1LMNAMAPT
SCHEMBL6961228 0.81 MTNR1B (0.41) ACEMAPTTP53
SCHEMBL6963127 0.81 F2RL1 (0.35) KCNH2F2RL1
SCHEMBL6957854 0.81 GHSR (0.38) ACEF2RL1KMT2AKDM4E
SCHEMBL6961296 0.80 ACE (0.46) ACELMNAMAPTSMN1; SMN2TP53
SCHEMBL6970287 0.80 MTNR1B (0.42) ACEMAPTTP53
SCHEMBL6967120 0.80 MTNR1B (0.42) ACEMAPTTP53
SCHEMBL6967615 0.80 MTNR1B (0.42) ACEMAPTTP53

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