SCHEMBL5067463

SCHEMBL5067463

CCOC(=O)N(CC)c1ccc(C(F)(F)F)cc1CN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ncc(CCOC(=O)C2CCNCC2)cn1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 8/20 0.36
CETP P11597 7/20 0.35
SLC6A4 P31645 3/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 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
SCHEMBL1587621 0.87 CETP (0.36) TACR1CETPSLC6A4SLC6A2
SCHEMBL5067467 0.86 TACR1 (0.40) TACR1CETPSLC6A4SLC6A2SLC6A3
SCHEMBL5067462 0.84 TACR1 (0.37) TACR1CETPSLC6A4
SCHEMBL1588631 0.80 CETP (0.51) CETP
SCHEMBL1587799 0.79 CETP (0.51) CETP
SCHEMBL1587626 0.79 CETP (0.41) CETP
SCHEMBL1588007 0.79 CETP (0.47) CETP
SCHEMBL1587796 0.78 CETP (0.47) CETP
SCHEMBL5072379 0.77 TACR1 (0.43) TACR1
SCHEMBL1587680 0.74 CETP (0.44) CETP

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-1979331-A1 TRISUBSTITUTED AMINE COMPOUNDS AS INHIBITORS OF -CHOLESTERYL ESTER TRANSFER PROTEIN CETP Mitsubishi Tanabe Pharma Corporation (JP) 2008-10-15 EP disclosed
WO-2007088996-A1 TRISUBSTITUTED AMINE COMPOUNDS AS INHIBITORS OF -CHOLESTERYL ESTER TRANSFER PROTEIN CETP MITSUBISHI TANABE PHARMA CORPORATION (JP) 2007-08-09 WO disclosed