SCHEMBL6961379

SCHEMBL6961379

CCC(C(=O)N1CCc2c[c]ccc2C1C(N)=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
ALDH1A1 P00352 4/20 0.42
TSHR P16473 3/20 0.42
KDM4E B2RXH2 2/20 0.42
HSD17B10 Q99714 1/20 0.42
ACE P12821 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
BCHE P06276 1/20 0.38
MTNR1B P49286 3/20 0.38
GHSR Q92847 1/20 0.37
LMNA P02545 2/20 0.37
MAPK1 P28482 1/20 0.37
RECQL P46063 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
F2RL1 P55085 1/20 0.36
ADORA1 P30542 1/20 0.35

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
SCHEMBL6970462 0.91 GHSR (0.43) ALDH1A1TSHRKDM4EHSD17B10ACE
SCHEMBL6974862 0.86 ACE (0.40) TSHRACEMTNR1BNPSR1F2RL1
SCHEMBL6974443 0.85 ACE (0.38) ACEMTNR1BF2RL1
SCHEMBL6970316 0.84 MTNR1B (0.40) ACEMTNR1BF2RL1
SCHEMBL6962527 0.81 ACE (0.40) ACEMTNR1BF2RL1
SCHEMBL6967926 0.80 ALDH1A1 (0.39) ALDH1A1TSHRACELMNAMAPK1
SCHEMBL6974568 0.79 ACE (0.39) ALDH1A1KDM4EACEF2RL1
SCHEMBL6972820 0.78 MEN1 (0.41) ALDH1A1ACEMTNR1BGHSR
SCHEMBL2848460 0.78 GRM2 (0.37) KDM4EACEMTNR1B
SCHEMBL3873900 0.78 SIRT1 (0.40) TSHRACEMTNR1BGHSRF2RL1

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