SCHEMBL6967876

SCHEMBL6967876

NC(=O)C1c2cc[c]cc2CCN1C(=O)c1ccco1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
PKM P14618 1/20 0.45
ALDH1A1 P00352 7/20 0.44
NPSR1 Q6W5P4 3/20 0.44
KDM4E B2RXH2 3/20 0.44
GAA P10253 1/20 0.44
TSHR P16473 3/20 0.44
HPGD P15428 2/20 0.44
HTT P42858 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CHRNA7 P36544 1/20 0.43
KMT2A Q03164 4/20 0.39
MAPK1 P28482 3/20 0.39
MEN1 O00255 2/20 0.39
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38

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 0.82 MEN1 (0.41) ALDH1A1HPGDKMT2AMEN1
SCHEMBL3873900 0.79 SIRT1 (0.40) SMN1; SMN2TSHRKMT2AMEN1
SCHEMBL6961208 0.79 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1NPSR1TSHRHPGD
SCHEMBL6969198 0.79 TSHR (0.42) MAPTSMN1; SMN2ALDH1A1KDM4EGAA
SCHEMBL6960917 0.79 L3MBTL1 (0.43) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL6968127 0.78 MAPK1 (0.39) ALDH1A1NPSR1KDM4EGAATSHR
SCHEMBL6961296 0.78 ACE (0.46) MAPTSMN1; SMN2TSHRHPGDTDP1
SCHEMBL4503987 0.77 F11 (0.40) MAPTSMN1; SMN2ALDH1A1NPSR1KDM4E
SCHEMBL6969704 0.77 MAPT (0.41) MAPTALDH1A1NPSR1GAATSHR
SCHEMBL6973247 0.76 LMNA (0.37) MAPTPKMALDH1A1KDM4ETSHR

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