SCHEMBL6684790

SCHEMBL6684790

CCC1(CC)c2ccccc2-c2ccc(-c3ccc4c(-c5ccc6c(c5)C(CC)(CC)c5ccccc5-6)c5ccc(-c6ccc7c(c6)C(CC)(CC)c6ccccc6-7)cc5c(-c5ccc6c(c5)C(CC)(CC)c5ccccc5-6)c4c3)cc21

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 20/20 0.37

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
SCHEMBL6683913 0.92 PDK2 (0.38) PDK2
SCHEMBL13936997 0.89 PDK2 (0.40) PDK2
SCHEMBL3886407 0.89 PDK2 (0.39) PDK2
SCHEMBL6680358 0.88 PDK2 (0.39) PDK2
SCHEMBL3887347 0.88 PDK2 (0.39) PDK2
SCHEMBL2129264 0.87 PDK2 (0.44) PDK2
SCHEMBL13937001 0.87 PDK2 (0.40) PDK2
SCHEMBL6680988 0.86 NPC1 (0.35) PDK2
SCHEMBL4370411 0.84 ALOX5 (0.43) PDK2
SCHEMBL10154008 0.83 PDK2 (0.48) PDK2

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
WO-2004053018-A1 ELECTROLUMINESCENT DEVICES XIE SHUANG (CA) 2004-06-24 WO disclosed
US-20030215667-A1 Electroluminescent devices ELIGHT CORPORATION (VG) 2003-11-20 US disclosed