SCHEMBL12423345

SCHEMBL12423345

CC1(C)CC(O)c2c(nc(C3CCOCC3)c3c2C2(CCCC2)O[C@@H]3c2ccc(S(F)(F)(F)(F)F)cc2)[C@@H]1O

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CETP P11597 20/20 0.59

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
SCHEMBL663370 1.00 CETP (0.59) CETP
SCHEMBL16258442 0.96 CETP (0.54) CETP
SCHEMBL12423349 0.96 CETP (0.54) CETP
SCHEMBL665376 0.96 CETP (0.54) CETP
SCHEMBL16258527 0.87 CETP (0.65) CETP
SCHEMBL12423813 0.87 CETP (0.65) CETP
SCHEMBL663737 0.87 CETP (0.65) CETP
SCHEMBL12423331 0.86 CETP (0.79) CETP
SCHEMBL664713 0.86 CETP (0.79) CETP
SCHEMBL16704833 0.84 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-2536733-B1 TRICYCLIC PYRIDINE DERIVATIVES, MEDICAMENTS CONTAINING SUCH COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PREPARATION BOEHRINGER INGELHEIM INT (DE) 2014-11-26 EP disclosed
WO-2011101424-A1 TRICYCLIC PYRIDINE DERIVATIVES, MEDICAMENTS CONTAINING SUCH COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PREPARATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-08-25 WO disclosed