SCHEMBL6961377

SCHEMBL6961377

Nc1ccc2c(c1)CCN(C(=O)Cc1ccccn1)C2

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.53
HTT P42858 2/20 0.53
KDR P35968 3/20 0.46
FNTA P49354 2/20 0.46
FNTB P49356 2/20 0.46
CNR1 P21554 1/20 0.45
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
KMT2A Q03164 1/20 0.44
ESR1 P03372 2/20 0.43
PTGDR2 Q9Y5Y4 2/20 0.43
ALDH1A1 P00352 2/20 0.43
NAMPT P43490 1/20 0.43
NR1H2 P55055 1/20 0.43
HCRTR2 O43614 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
LMNA P02545 1/20 0.42
STS P08842 1/20 0.42

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
SCHEMBL6643066 0.90 CNR1 (0.46) KDM4EHTTKDRFNTAFNTB
SCHEMBL10577926 0.86 KDM4E (0.67) KDM4EHTTRAB9ANPC1KMT2A
SCHEMBL1027651 0.83 HDAC6 (0.54) KDM4EHTTRAB9ANPC1ESR1
Hydrochloric Acid SCHEMBL1027434 0.82 HDAC6 (0.53) KDM4EHTTRAB9ANPC1ESR1
SCHEMBL6638802 0.80 EIF2AK3 (0.52) HTTCNR1RAB9ANPC1KMT2A
SCHEMBL6492613 0.80 EIF2AK3 (0.59) KDM4ERAB9ANPC1KMT2AALDH1A1
SCHEMBL6974860 0.80 GAA (0.55) HTTKDRRAB9ANPC1KMT2A
SCHEMBL1025763 0.79 KDM4E (0.53) KDM4EHTTRAB9ANPC1KMT2A
Hydrochloric Acid SCHEMBL2278289 0.78 KDM4E (0.52) KDM4EHTTRAB9ANPC1KMT2A
SCHEMBL6974709 0.78 NPC1 (0.57) RAB9ANPC1KMT2AALDH1A1NR1H2

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