SCHEMBL6969261

SCHEMBL6969261

CSc1ccc(CN2CCc3cc(N)ccc3C2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.52
NOD2 Q9HC29 1/20 0.52
NOD1 Q9Y239 1/20 0.52
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
ABCB1 P08183 4/20 0.46
ABCC1 P33527 2/20 0.43
ABCG2 Q9UNQ0 2/20 0.43
NOS1 P29475 1/20 0.43
LMNA P02545 1/20 0.43
DRD4 P21917 2/20 0.43
HTR2B P41595 2/20 0.43
TMEM97 Q5BJF2 2/20 0.43
SIGMAR1 Q99720 2/20 0.43
CHRM2 P08172 1/20 0.43
HTR1A P08908 1/20 0.43
CHRM3 P20309 1/20 0.43
ADRA1D P25100 1/20 0.43
HTR2C P28335 1/20 0.43
ADRA1A P35348 1/20 0.43

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
SCHEMBL6962643 0.83 ACACB (0.51) TNFNOD2NOD1KMT2AMEN1
SCHEMBL6973388 0.82 TMEM97 (0.60) KMT2AMEN1NOS1DRD4HTR2B
SCHEMBL6968428 0.82 TNF (0.52) TNFNOD2NOD1KMT2AMEN1
SCHEMBL6973737 0.82 ACACB (0.56) LMNA
SCHEMBL6966893 0.82 ACACB (0.47) KMT2AMEN1ABCB1ABCC1ABCG2
SCHEMBL6969210 0.82 ABCB1 (0.65) TNFNOD2NOD1KMT2AABCB1
SCHEMBL6966743 0.80 TMEM97 (0.58) KMT2AMEN1ABCB1ABCC1ABCG2
SCHEMBL6974754 0.80 POLB (0.50) NOD1KMT2AMEN1DRD4HTR2B
SCHEMBL6972430 0.80 DRD2 (0.53) KMT2AMEN1ABCB1ABCC1ABCG2
SCHEMBL6966204 0.80 TMEM97 (0.55) KMT2AMEN1ABCB1ABCC1ABCG2

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