SCHEMBL19001802

SCHEMBL19001802

CC1(C)c2ccccc2-c2c(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cccc5c4-c4ccccc4C54c5ccccc5-c5c(-c6ccccc6)cccc54)cc3)cccc21

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.33

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
SCHEMBL19010500 0.99 PDK2 (0.33) PDK2
SCHEMBL17816673 0.99 PDK2 (0.33) PDK2
SCHEMBL19001801 0.97 PDK2 (0.33) PDK2
SCHEMBL18457602 0.95 PDK2 (0.33) PDK2
SCHEMBL20434336 0.95 PDK2 (0.35) PDK2
SCHEMBL20998116 0.94 PDK2 (0.32) PDK2
SCHEMBL20434338 0.94 PDK2 (0.34) PDK2
SCHEMBL20434353 0.94 PDK2 (0.34) PDK2
SCHEMBL20434448 0.94 PDK2 (0.34) PDK2
SCHEMBL17816777 0.94 PDK2 (0.34) 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
EP-3390365-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-04-14 EP disclosed
WO-2017102063-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-06-22 WO disclosed