SCHEMBL6972567

SCHEMBL6972567

NC(=O)C1c2cc[c]cc2CCN1Cc1cccc(F)c1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 16/20 0.42
MAOA P21397 14/20 0.42
DRD2 P14416 1/20 0.39
KCNH2 Q12809 1/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL6965834 0.88 ESR1 (0.39) MAOBMAOA
SCHEMBL6974425 0.88 GBA1 (0.39) KMT2AKDM4EALDH1A1
SCHEMBL6972456 0.88 KDM4E (0.40) KMT2AKDM4E
SCHEMBL6974038 0.87 ALDH1A1 (0.42) KMT2AKDM4EALDH1A1
SCHEMBL6966047 0.87 ESR1 (0.37) KCNH2KMT2A
SCHEMBL6957504 0.86 SIRT2 (0.44) KCNH2
SCHEMBL6967397 0.85 SIRT2 (0.45) KMT2AKDM4EALDH1A1
SCHEMBL6971131 0.85 SIRT2 (0.43) MAOBDRD2KCNH2KMT2AKDM4E
SCHEMBL6973895 0.85 ALDH1A1 (0.37) ALDH1A1NPC1
SCHEMBL6960589 0.84 KMT2A (0.45) KMT2AKDM4EALDH1A1

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