SCHEMBL4973254

SCHEMBL4973254

CC(C)(O)COc1cc(C(c2ccccc2)C(NC(=O)NC2CCCC2)c2cc(F)cc(C(F)(F)F)c2)ccc1F

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CETP P11597 15/20 0.42
EPHX1 P07099 2/20 0.38
LMNA P02545 1/20 0.38
OPRL1 P41146 1/20 0.36

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
SCHEMBL14244157 0.84 CETP (0.47) CETPEPHX1LMNA
SCHEMBL760548 0.80 CETP (0.42) CETPEPHX1LMNAOPRL1
SCHEMBL760727 0.75 CETP (0.68) CETP
SCHEMBL760726 0.75 CETP (0.68) CETP
SCHEMBL762000 0.70 EPHX2 (0.47) CETPEPHX1LMNA
SCHEMBL760148 0.67 CETP (0.69) CETP
SCHEMBL760147 0.67 CETP (0.69) CETP
SCHEMBL4968308 0.65 NPSR1 (0.44) LMNA
SCHEMBL760181 0.65 CETP (0.68) CETP
SCHEMBL760180 0.65 CETP (0.68) 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-1954668-A2 HOMO- AND HETEROCYCLIC COMPOUNDS SUITABLE AS CETP INHIBITORS Brystol-Myers Squibb Company (US) 2008-08-13 EP disclosed
WO-2007062308-A2 HOMO- AND HETEROCYCLIC COMPOUNDS SUITABLE AS CETP INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-05-31 WO disclosed