SCHEMBL759876

SCHEMBL759876

CNC(=O)c1cc(C(Cc2ccccc2)(NC(=O)c2ccc(F)c(C(F)(F)F)c2)c2cc(F)cc(OC(F)(F)C(F)F)c2)ccc1F.O=C(NC(F)(F)F)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CETP P11597 20/20 0.66
KCNH2 Q12809 7/20 0.52

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
SCHEMBL760217 0.98 CETP (0.68) CETPKCNH2
SCHEMBL759875 0.92 CETP (0.62) CETPKCNH2
SCHEMBL758957 0.91 CETP (0.69) CETPKCNH2
SCHEMBL758956 0.91 CETP (0.69) CETPKCNH2
SCHEMBL3056845 0.91 CETP (0.71) CETPKCNH2
SCHEMBL3056850 0.91 CETP (0.71) CETPKCNH2
SCHEMBL760044 0.90 CETP (0.68) CETPKCNH2
SCHEMBL765733 0.90 CETP (0.76) CETPKCNH2
SCHEMBL765734 0.90 CETP (0.76) CETPKCNH2
SCHEMBL757996 0.90 CETP (0.69) CETPKCNH2

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-1954668-B9 HOMO- AND HETEROCYCLIC COMPOUNDS SUITABLE AS CETP INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2012-03-21 EP claimed
EP-1954668-B1 HOMO- AND HETEROCYCLIC COMPOUNDS SUITABLE AS CETP INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2011-09-28 EP claimed