SCHEMBL21764655

SCHEMBL21764655

c1ccc(-c2ccc(N(c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)c3cccc4c5ccccc5c5ccccc5c5ccccc5c5ccccc5c34)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.35

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
SCHEMBL19218760 1.00 PDK2 (0.35) PDK2
SCHEMBL19218757 1.00 PDK2 (0.35) PDK2
SCHEMBL19218767 0.98 PDK2 (0.33) PDK2
SCHEMBL19218758 0.98 PDK2 (0.36) PDK2
SCHEMBL19218769 0.96 PDK2 (0.32) PDK2
SCHEMBL19218759 0.95 PDK2 (0.36) PDK2
SCHEMBL19218763 0.94 PDK2 (0.36) PDK2
SCHEMBL19218792 0.93 PDK2 (0.31) PDK2
SCHEMBL19218752 0.93 PDK2 (0.33) PDK2
SCHEMBL19218766 0.93 PDK2 (0.33) 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-3227269-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-02-26 EP disclosed