SCHEMBL6274573

SCHEMBL6274573

Cc1cccc(Oc2cccc(C(NC[C@@H](O)C(F)(F)F)c3cccc(C(F)(F)C(F)(F)F)c3)c2)c1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CETP P11597 12/20 0.40
ADRB2 P07550 1/20 0.37
ADRB1 P08588 1/20 0.37
GAA P10253 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
AOC3 Q16853 1/20 0.34

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
SCHEMBL5668400 1.00 CETP (0.40) CETPADRB2ADRB1GAANPSR1
SCHEMBL6064659 0.95 CETP (0.43) CETPAOC3
SCHEMBL6064872 0.95 CETP (0.43) CETPAOC3
SCHEMBL1901048 0.94 CETP (0.39) CETPADRB2ADRB1GAANPSR1
SCHEMBL6273100 0.94 CETP (0.39) CETPADRB2ADRB1GAANPSR1
SCHEMBL5670800 0.93 CETP (0.44) CETP
SCHEMBL6568898 0.93 CETP (0.44) CETP
SCHEMBL5670346 0.92 CETP (0.41) CETPAOC3
SCHEMBL6568915 0.92 CETP (0.41) CETPAOC3
SCHEMBL6823366 0.91 CETP (0.43) CETPAOC3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005117869-A1 COMBINATIONS COMPRISING (S)-AMLODIPINE AND A CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITOR, AND METHODS FOR REDUCING HYPERTENSION SEPRACOR INC. (US) 2005-12-15 WO disclosed
EP-1469831-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING A SOLID AMORPHOUS DISPERSION OF CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITORS Pfizer Products Inc. (US) 2004-10-27 EP disclosed
EP-1401399-A2 PHARMACEUTICAL COMPOSITIONS CONTAINING POLYMER AND DRUG ASSEMBLIES Pfizer Products Inc. (US) 2004-03-31 EP disclosed
WO-2003063832-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING A SOLID AMORPHOUS DISPERSION OF CHOLESTERYL ESTER TRANSFER PROTEIN INHIBITORS PFIZER PRODUCTS INC. (US) 2003-08-07 WO disclosed
WO-2003000226-A2 PHARMACEUTICAL COMPOSITIONS CONTAINING POLYMER AND DRUG ASSEMBLIES PFIZER PRODUCTS INC. (US) 2003-01-03 WO disclosed