SCHEMBL6588903

SCHEMBL6588903

CCOC(=O)N1c2cc(OC)c(OC)cc2[C@@H](N(Cc2ccccc2)C(=O)OC)C[C@H]1C

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CETP P11597 3/20 0.49
PTGDR2 Q9Y5Y4 5/20 0.46
NPSR1 Q6W5P4 1/20 0.42
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
ABCB1 P08183 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HCRTR1 O43613 1/20 0.37
HCRTR2 O43614 1/20 0.37
BCHE P06276 2/20 0.36
ACHE P22303 2/20 0.36
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL6588905 1.00 CETP (0.49) CETPPTGDR2NPSR1ALDH1A1LMNA
SCHEMBL6588898 1.00 CETP (0.49) CETPPTGDR2NPSR1ALDH1A1LMNA
SCHEMBL6596024 0.94 PTGDR2 (0.45) CETPPTGDR2NPSR1ALDH1A1LMNA
SCHEMBL6596028 0.94 PTGDR2 (0.45) CETPPTGDR2NPSR1ALDH1A1LMNA
SCHEMBL6596027 0.94 PTGDR2 (0.45) CETPPTGDR2NPSR1ALDH1A1LMNA
SCHEMBL6594646 0.93 PTGDR2 (0.49) CETPPTGDR2NPSR1ALDH1A1LMNA
SCHEMBL6594651 0.93 PTGDR2 (0.49) CETPPTGDR2NPSR1ALDH1A1LMNA
SCHEMBL6594641 0.93 PTGDR2 (0.49) CETPPTGDR2NPSR1ALDH1A1LMNA
SCHEMBL6592155 0.93 CETP (0.49) CETPPTGDR2NPSR1ALDH1A1KDM4E
SCHEMBL6592150 0.93 CETP (0.49) CETPPTGDR2NPSR1ALDH1A1KDM4E

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-0987251-B1 4-carboxyamino-2-methyl-1,2,3,4-tetrahydroquinolines as CETP inhibitors PFIZER PROD INC (US) 2004-05-19 EP disclosed
US-6362198-B1 ANTICHOLESTEROL, ANTILIPEMIC AGENT PFIZER INC. 2002-03-26 US disclosed
US-6140342-A CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITOR; USED TO ELEVATE CERTAIN PLASMA LIPID LEVELS, INCLUDING HIGH DENSITY LIPOPROTEIN-CHOLESTEROL AND TO LOWER CERTAIN OTHER PLASMA LIPID LEVELS, SUCH AS LDL-CHOLESTEROL AND TRIGLYCERIDES PFIZER INC. (US) 2000-10-31 US disclosed
EP-0987251-A1 4-carboxyamino-2-methyl-1,2,3,4-tetrahydroquinolines as CETP inhibitors Pfizer Products Inc. (US) 2000-03-22 EP disclosed