SCHEMBL10245315

SCHEMBL10245315

COc1cc(F)c(C(C)C)cc1-c1ccc(C)cc1CN1C(=O)OC(c2cc(C)cc(C(F)(F)F)c2)C1C

nearest known ligand 0.94

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CETP P11597 20/20 0.94
NR1I2 O75469 1/20 0.83

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
SCHEMBL15706605 1.00 CETP (0.94) CETPNR1I2
SCHEMBL17585956 1.00 CETP (0.94) CETPNR1I2
SCHEMBL10242846 0.97 CETP (1.00) CETPNR1I2
SCHEMBL531346 0.97 CETP (1.00) CETPNR1I2
SCHEMBL13395294 0.97 CETP (1.00) CETPNR1I2
SCHEMBL17424125 0.96 CETP (0.86) CETPNR1I2
SCHEMBL17366580 0.95 CETP (0.91) CETPNR1I2
SCHEMBL17585942 0.95 CETP (0.91) CETPNR1I2
SCHEMBL10242813 0.95 CETP (0.91) CETPNR1I2
SCHEMBL15927667 0.95 CETP (0.91) CETPNR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2415759-A1 CETP inhibitors Merck Sharp & Dohme Corporation (US) 2012-02-08 EP disclosed