SCHEMBL6973111

SCHEMBL6973111

NC(=O)C1c2cc[c]cc2CCN1C(=O)C1(c2ccccc2)CCCC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
HSD11B1 P28845 7/20 0.39
NPSR1 Q6W5P4 2/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
TSHR P16473 1/20 0.37
AKR1C1 Q04828 1/20 0.37
EP300 Q09472 1/20 0.37
CREBBP Q92793 1/20 0.37
HSD17B10 Q99714 1/20 0.35
HDAC4 P56524 2/20 0.34
OPRD1 P41143 1/20 0.34
KCNH2 Q12809 1/20 0.34
SIGMAR1 Q99720 3/20 0.34
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
GPR55 Q9Y2T6 1/20 0.33

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
SCHEMBL6974045 0.82 KCNH2 (0.32) KCNH2
SCHEMBL6972820 0.79 MEN1 (0.41) MEN1KMT2AHSD11B1ALDH1A1
SCHEMBL6974862 0.76 ACE (0.40) MEN1KMT2ANPSR1TSHR
SCHEMBL6975684 0.76 HSD11B1 (0.44) SMN1; SMN2HSD11B1NPSR1ALDH1A1LMNA
SCHEMBL3873900 0.76 SIRT1 (0.40) MEN1KMT2ASMN1; SMN2TSHR
SCHEMBL6961208 0.75 SMN1; SMN2 (0.44) MEN1KMT2ASMN1; SMN2HSD11B1NPSR1
SCHEMBL6961296 0.74 ACE (0.46) SMN1; SMN2LMNATSHRSIGMAR1
SCHEMBL6961129 0.74 AR (0.34)
SCHEMBL6967292 0.74 KEAP1 (0.38) MEN1KMT2ASMN1; SMN2NPSR1ALDH1A1
SCHEMBL6960958 0.74 F2 (0.36) NPSR1ALDH1A1TSHR

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