SCHEMBL6965869

SCHEMBL6965869

NC(=O)C1c2cc[c]cc2CCN1C(=O)Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
LMNA P02545 2/20 0.50
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
RECQL P46063 1/20 0.42
KCNJ1 P48048 1/20 0.41
KCNH2 Q12809 1/20 0.41
KDM4E B2RXH2 2/20 0.40
POLB P06746 3/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
OPRK1 P41145 1/20 0.38
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38
DPP7 Q9UHL4 1/20 0.38
SIGMAR1 Q99720 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
HSP90AA1 P07900 1/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL6965563 0.86 PARP1 (0.42) KDM4EKMT2AMEN1
SCHEMBL6970725 0.86 SMN1; SMN2 (0.42) ALDH1A1LMNAMAPTSMN1; SMN2KDM4E
SCHEMBL6974704 0.84 MAPT (0.40) ALDH1A1LMNAMAPTSMN1; SMN2KDM4E
SCHEMBL6968134 0.81 UTS2R (0.40) ALDH1A1LMNAMAPTSMN1; SMN2KDM4E
SCHEMBL6974644 0.80 CYP1A2 (0.40) MAPTKDM4EPOLBDPP4DPP8
SCHEMBL6962485 0.79 PARP1 (0.47) KDM4EKMT2AMEN1OPRK1SIGMAR1
SCHEMBL6968799 0.78 LMNA (0.48) LMNAMAPTSMN1; SMN2KDM4EKMT2A
SCHEMBL6961296 0.78 ACE (0.46) LMNAMAPTSMN1; SMN2POLBSIGMAR1
SCHEMBL6973366 0.77 ACE (0.41) KDM4E
SCHEMBL6973348 0.77 PARP1 (0.49) ALDH1A1LMNAKDM4EKMT2AMEN1

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