SCHEMBL5069573

SCHEMBL5069573

CCCN(CC1CC1)c1ccc(C(F)(F)F)cc1CCN(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ncc(N2CCC(C(=O)OCC)CC2)cn1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CETP P11597 9/20 0.40
L3MBTL1 Q9Y468 2/20 0.36
PDK2 Q15119 1/20 0.35
MAPT P10636 1/20 0.34
LGMN Q99538 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 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
SCHEMBL1587720 0.86 CETP (0.41) CETPL3MBTL1PDK2MAPTKMT2A
SCHEMBL1587680 0.83 CETP (0.44) CETPL3MBTL1PDK2
SCHEMBL1587600 0.82 CETP (0.49) CETPL3MBTL1PDK2LGMN
SCHEMBL1587798 0.79 CETP (0.39) CETPPDK2
SCHEMBL13910237 0.79 CETP (0.41) CETPL3MBTL1PDK2LGMNMEN1
SCHEMBL1588251 0.78 CETP (0.46) CETP
SCHEMBL132026 0.77 CETP (0.45) CETPL3MBTL1MEN1KMT2A
SCHEMBL1587641 0.77 CETP (0.40) CETP
SCHEMBL1588631 0.76 CETP (0.51) CETPL3MBTL1
SCHEMBL1587799 0.76 CETP (0.51) CETPL3MBTL1

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