SCHEMBL91610

SCHEMBL91610

CCC1(CC)c2ccccc2-c2ncc(-c3ccc(-c4ccc(-c5cnc6c(c5)C(CC)(CC)C5C=CC=CC65)cc4C)c(C)c3)cc21

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.31

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
SCHEMBL82060 0.83 PDK2 (0.40) PDK2
SCHEMBL80367 0.66 PDK2 (0.36) PDK2
SCHEMBL2129264 0.63 PDK2 (0.44) PDK2
SCHEMBL80381 0.60 PDK2 (0.45) PDK2
SCHEMBL80922 0.60 PDK2 (0.45) PDK2
SCHEMBL13858046 0.60 PDK2 (0.47) PDK2
SCHEMBL81239 0.60 PDK2 (0.44) PDK2
SCHEMBL28055711 0.60 PDK2 (0.51) PDK2
SCHEMBL29645267 0.59 PDK2 (0.33) PDK2
SCHEMBL80833 0.58 PDK2 (0.39) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129899-B1 Azafluorene derivative and organic light-emitting device using the derivative CANON KABUSHIKI KAISHA (JP) 2012-03-06 US disclosed