SCHEMBL6969736

SCHEMBL6969736

Nc1ccc2c(c1)CCN(C(=O)CCC1CCCC1)C2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 1/20 0.47
▸ TP53 P04637 1/20 0.46
▸ ENPP2 Q13822 1/20 0.45
▸ ALDH1A1 P00352 7/20 0.44
▸ LMNA P02545 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ HDAC6 Q9UBN7 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ HDAC3 O15379 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC10 Q969S8 1/20 0.41
▸ HDAC11 Q96DB2 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL13498396 0.88 ENPP2 (0.47) NR1H2ENPP2ALDH1A1MAPTTDP1
SCHEMBL6973945 0.81 NR1H2 (0.52) NR1H2ALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL6961357 0.80 HPGD (0.49) NR1H2ALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL6973919 0.80 NR1H2 (0.51) NR1H2ALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL6961235 0.79 SGPL1 (0.51) NR1H2ALDH1A1LMNAMAPTTDP1
SCHEMBL6967124 0.78 HDAC3 (0.52) NR1H2ALDH1A1LMNAMAPTTDP1
SCHEMBL6970290 0.78 HDAC3 (0.52) NR1H2ALDH1A1LMNAMAPTTDP1
SCHEMBL6967617 0.78 HDAC3 (0.52) NR1H2ALDH1A1LMNAMAPTTDP1
SCHEMBL6962036 0.78 HDAC3 (0.52) NR1H2ALDH1A1LMNAMAPTTDP1
SCHEMBL6957857 0.77 NR1H2 (0.57) NR1H2HDAC6KMT2AKDM4EMEN1

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
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