SCHEMBL7627451

SCHEMBL7627451

CCCC(C)(C)C(=O)N1CCc2c[c]ccc2C1C(N)=O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
RIPK1 Q13546 2/20 0.32
ACE P12821 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
SCHEMBL6975153 0.88 MEN1 (0.34) MEN1KMT2ARIPK1ACE
SCHEMBL6962545 0.86 MEN1 (0.41) MEN1KMT2ARIPK1ACE
SCHEMBL6973366 0.82 ACE (0.41) ACE
SCHEMBL6957854 0.81 GHSR (0.38) MEN1KMT2AACE
SCHEMBL6973916 0.80 TP53 (0.41) ACE
SCHEMBL3873900 0.80 SIRT1 (0.40) MEN1KMT2AACE
SCHEMBL6961228 0.79 MTNR1B (0.41) ACE
SCHEMBL6974443 0.79 ACE (0.38) MEN1KMT2AACE
SCHEMBL6970287 0.78 MTNR1B (0.42) ACE
SCHEMBL6967615 0.78 MTNR1B (0.42) ACE

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-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
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