SCHEMBL16258247

SCHEMBL16258247

CCOC(=O)c1c(C2CCOCC2)nc2c(c1C1=CCOCC1)C(O[Si](C)(C)C(C)(C)C)CC(C)(C)C2

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CETP P11597 10/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL10238490 1.00 CETP (0.32) CETPCYP1A2CYP2C9CYP2C19LMNA
SCHEMBL10238491 0.91 CETP (0.34) CETP
SCHEMBL16258245 0.91 CETP (0.34) CETP
SCHEMBL665469 0.91 CETP (0.33) CETP
SCHEMBL10238464 0.86 CETP (0.32) CETPCYP1A2CYP2C9CYP2C19LMNA
SCHEMBL16258329 0.86 CETP (0.32) CETPCYP1A2CYP2C9CYP2C19LMNA
SCHEMBL16258270 0.85 LMNA (0.35) CETPCYP1A2CYP2C9CYP2C19LMNA
SCHEMBL662904 0.84 CETP (0.34) CETP
SCHEMBL662903 0.84 CETP (0.34) CETP
SCHEMBL664789 0.83 CETP (0.32) 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