SCHEMBL6974709

SCHEMBL6974709

Nc1ccc2c(c1)CCN(C(=O)Cc1ccc(-c3ccccc3)cc1)C2

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.57
RAB9A P51151 1/20 0.57
KMT2A Q03164 3/20 0.56
ABCB1 P08183 1/20 0.55
ABCC1 P33527 1/20 0.55
MAPT P10636 1/20 0.51
ROCK2 O75116 1/20 0.51
MEN1 O00255 2/20 0.48
TMPRSS2 O15393 1/20 0.47
HRH3 Q9Y5N1 2/20 0.46
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
PDE4B Q07343 1/20 0.44
ALDH1A1 P00352 1/20 0.44
NR1H2 P55055 1/20 0.44
FAAH O00519 1/20 0.43
NAAA Q02083 1/20 0.43
ROCK1 Q13464 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
SCHEMBL6965569 0.85 NPC1 (0.53) NPC1RAB9AKMT2AABCB1ABCC1
SCHEMBL6970730 0.85 NPC1 (0.53) NPC1RAB9AKMT2AABCB1ABCC1
SCHEMBL6968137 0.85 NPC1 (0.53) NPC1RAB9AKMT2AABCB1ABCC1
SCHEMBL1264149 0.83 HDAC6 (0.68) NPC1RAB9AKMT2AABCB1ABCC1
SCHEMBL6490372 0.82 HDAC1 (0.58) NPC1RAB9AKMT2AROCK2MEN1
SCHEMBL6961213 0.81 MEN1 (0.65) NPC1KMT2AMEN1SMN1; SMN2HDAC6
SCHEMBL6965875 0.81 ALDH1A1 (0.52) NPC1RAB9AKMT2AABCB1ABCC1
SCHEMBL6961304 0.81 ALDH1A1 (0.53) NPC1KMT2AMEN1TMPRSS2TSHR
SCHEMBL5096699 0.80 KMT2A (0.86) NPC1KMT2AABCB1ABCC1MEN1
SCHEMBL6962490 0.80 KMT2A (0.56) NPC1RAB9AKMT2AMEN1SMN1; SMN2

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