SCHEMBL6965875

SCHEMBL6965875

Nc1ccc2c(c1)CCN(C(=O)Cc1ccc([N+](=O)[O-])cc1)C2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
LMNA P02545 2/20 0.52
RECQL P46063 1/20 0.51
KCNJ1 P48048 1/20 0.50
KCNH2 Q12809 1/20 0.50
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
KDM4E B2RXH2 1/20 0.48
HPGD P15428 2/20 0.48
KMT2A Q03164 5/20 0.47
MEN1 O00255 4/20 0.47
POLB P06746 2/20 0.47
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
PDE4B Q07343 1/20 0.46
PDE4D Q08499 1/20 0.46
GAA P10253 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
ABCB1 P08183 1/20 0.45
ABCC1 P33527 1/20 0.45

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
SCHEMBL6970730 0.83 NPC1 (0.53) ALDH1A1RAB9ANPC1KMT2AMEN1
SCHEMBL6965569 0.83 NPC1 (0.53) ALDH1A1LMNARAB9ANPC1KMT2A
SCHEMBL6974709 0.81 NPC1 (0.57) ALDH1A1RAB9ANPC1KMT2AMEN1
SCHEMBL10656628 0.81 KMT2A (0.71) ALDH1A1LMNANPC1KDM4EKMT2A
SCHEMBL6968137 0.78 NPC1 (0.53) ALDH1A1LMNARAB9ANPC1HPGD
SCHEMBL6640413 0.77 CPT2 (0.47) ALDH1A1LMNARECQLKCNJ1KCNH2
SCHEMBL11385360 0.77 KMT2A (0.62) ALDH1A1LMNARECQLKCNJ1KCNH2
SCHEMBL6974651 0.77 CYP1A2 (0.47) RAB9ANPC1KMT2AMEN1POLB
SCHEMBL12393135 0.77 RECQL (0.53) ALDH1A1LMNARECQLKCNJ1KCNH2
SCHEMBL6394265 0.76 PTPN2 (0.53) ALDH1A1LMNARAB9ANPC1HPGD

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