SCHEMBL20198347

SCHEMBL20198347

c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(NOc3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)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
SCHEMBL808146 0.77 PDK2 (0.54) PDK2
SCHEMBL17993818 0.75 PDK2 (0.57) PDK2
SCHEMBL17965671 0.75 PDK2 (0.57) PDK2
Phosphine SCHEMBL23633149 0.75 PDK2 (0.53) PDK2
SCHEMBL16596686 0.75 MAPT (0.52) PDK2
SCHEMBL25764465 0.74 PDK2 (0.61) PDK2
SCHEMBL16002573 0.73 PDK2 (0.50) PDK2
SCHEMBL904506 0.73 PDK2 (0.62) PDK2
SCHEMBL31552466 0.73 PDK2 (0.62) PDK2
SCHEMBL31131453 0.73 PDK2 (0.62) 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
EP-1675930-B1 NEW MATERIALS FOR ELECTROLUMINESCENCE AND THE UTILIZATION THEREOF MERCK PATENT GMBH (DE) 2018-05-30 EP disclosed