SCHEMBL6969655

SCHEMBL6969655

NC(=O)C1c2cc[c]cc2CCN1Cc1cccc(Br)n1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.37
ACHE P22303 1/20 0.31
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
NCOR2 Q9Y618 1/20 0.30

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
SCHEMBL6967680 0.89 KMT2A (0.38)
SCHEMBL6975480 0.87
SCHEMBL6957978 0.84 SIRT1 (0.41)
SCHEMBL6965484 0.84 FAAH (0.39) FAAHHDAC3HDAC1HDAC2HDAC8
SCHEMBL6970691 0.81 KDM4E (0.32) HDAC1HDAC8
SCHEMBL6966047 0.80 ESR1 (0.37) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL6973247 0.80 LMNA (0.37)
SCHEMBL6961872 0.79 GRM2 (0.41)
SCHEMBL6976521 0.79 GRM2 (0.41) FAAHACHEHDAC3HDAC1HDAC2
SCHEMBL6967724 0.79

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 2 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