SCHEMBL6964658

SCHEMBL6964658

NC(=O)C1c2cc[c]cc2CCN1C(=O)Cc1cccs1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.38
ALDH1A1 P00352 5/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
HSD17B10 Q99714 2/20 0.37
MAPT P10636 2/20 0.36
POLB P06746 2/20 0.36
KDM4E B2RXH2 2/20 0.35
LMNA P02545 2/20 0.35
HPGD P15428 1/20 0.35
CASP1 P29466 1/20 0.35
ACE P12821 1/20 0.35
GFER P55789 1/20 0.35
PKM P14618 1/20 0.34
TSHR P16473 1/20 0.34
CASP3 P42574 1/20 0.33
CASP7 P55210 1/20 0.33
P2RX7 Q99572 1/20 0.33

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
SCHEMBL6962344 0.83 KDM4E (0.39) HTTALDH1A1SMN1; SMN2HSD17B10POLB
SCHEMBL6969198 0.82 TSHR (0.42) HTTALDH1A1SMN1; SMN2HSD17B10MAPT
SCHEMBL6974644 0.81 CYP1A2 (0.40) MAPTPOLBKDM4EACEPKM
SCHEMBL6967281 0.80 GAA (0.37) HTTALDH1A1SMN1; SMN2HSD17B10POLB
SCHEMBL6974704 0.79 MAPT (0.40) HTTALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL6965563 0.79 PARP1 (0.42) KMT2AMEN1KDM4EHPGDGFER
SCHEMBL6970725 0.79 SMN1; SMN2 (0.42) ALDH1A1KMT2AMEN1SMN1; SMN2MAPT
SCHEMBL6961372 0.78 PARP1 (0.46) HTTALDH1A1POLBKDM4EACE
SCHEMBL6973366 0.78 ACE (0.41) KDM4EACE
SCHEMBL6964052 0.78 ACE (0.33) KDM4EACE

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 5 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 claimed
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 claimed
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 claimed
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 claimed
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