SCHEMBL6961208

SCHEMBL6961208

NC(=O)C1c2cc[c]cc2CCN1C(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
HDAC6 Q9UBN7 1/20 0.40
POLB P06746 2/20 0.40
HPGD P15428 2/20 0.39
MAPK1 P28482 1/20 0.39
CA12 O43570 6/20 0.38
CA1 P00915 6/20 0.38
CA2 P00918 6/20 0.38
CA7 P43166 6/20 0.38
CA9 Q16790 6/20 0.38
CA14 Q9ULX7 6/20 0.38
AVPR2 P30518 1/20 0.38
OXTR P30559 1/20 0.38
AVPR1A P37288 1/20 0.38
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
SLC6A7 Q99884 1/20 0.36
TSHR P16473 2/20 0.36
TP53 P04637 1/20 0.36
FASN P49327 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
SCHEMBL6972820 0.93 MEN1 (0.41) HPGDCA12CA1CA2CA7
SCHEMBL6968127 0.84 MAPK1 (0.39) POLBHPGDMAPK1MEN1KMT2A
SCHEMBL6974704 0.84 MAPT (0.40) SMN1; SMN2TSHRALDH1A1LMNA
SCHEMBL6960917 0.80 L3MBTL1 (0.43) SMN1; SMN2POLBKMT2AALDH1A1
SCHEMBL6966740 0.79 HDAC1 (0.39) HDAC6MEN1KMT2AALDH1A1LMNA
SCHEMBL6974862 0.79 ACE (0.40) MEN1KMT2ATSHRNPSR1
SCHEMBL6967876 0.79 MAPT (0.46) SMN1; SMN2HPGDMAPK1MEN1KMT2A
SCHEMBL3873900 0.78 SIRT1 (0.40) SMN1; SMN2POLBMEN1KMT2ATSHR
SCHEMBL6961500 0.78 TSHR (0.52) SMN1; SMN2POLBMEN1KMT2ATSHR
SCHEMBL16303966 0.78 ACE (0.50) HPGDCA12CA1CA2CA7

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