SCHEMBL6960958

SCHEMBL6960958

NC(=O)C1c2cc[c]cc2CCN1C(=O)C1c2ccccc2-c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.36
ACE P12821 2/20 0.35
F11 P03951 1/20 0.33
F2RL1 P55085 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KEAP1 Q14145 9/20 0.32
DPP8 Q6V1X1 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
TSHR P16473 1/20 0.32
NFE2L2 Q16236 3/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL4503987 0.82 F11 (0.40) ACEF11F2RL1ALDH1A1NPSR1
SCHEMBL6972820 0.80 MEN1 (0.41) ACEALDH1A1
SCHEMBL6967292 0.80 KEAP1 (0.38) F11F2RL1ALDH1A1NPSR1KEAP1
SCHEMBL3873900 0.79 SIRT1 (0.40) ACEF2RL1TSHR
SCHEMBL6969807 0.79 KEAP1 (0.42) F11F2RL1ALDH1A1NPSR1KEAP1
SCHEMBL6967233 0.78 ALDH1A1 (0.45) ALDH1A1NPSR1KEAP1TSHRNFE2L2
SCHEMBL6974862 0.77 ACE (0.40) ACEF2RL1NPSR1TSHR
SCHEMBL6965284 0.77 NPC1 (0.46) ACEALDH1A1TSHR
SCHEMBL6960917 0.76 L3MBTL1 (0.43) F2RL1ALDH1A1L3MBTL1
SCHEMBL6961208 0.76 SMN1; SMN2 (0.44) ALDH1A1NPSR1TSHR

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 2 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