SCHEMBL19001940

SCHEMBL19001940

CC1(C)c2ccccc2-c2ccc(N(c3ccc4cc(-c5ccccc5)ccc4c3)c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccc(-c5ccccc5)cc43)cc21

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.34

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
SCHEMBL20998097 0.97 PDK2 (0.33) PDK2
SCHEMBL22425194 0.95 PDK2 (0.32) PDK2
SCHEMBL19001937 0.95 PDK2 (0.37) PDK2
SCHEMBL19001816 0.95 PDK2 (0.37) PDK2
SCHEMBL19001920 0.95 PDK2 (0.37) PDK2
SCHEMBL23222546 0.95 PDK2 (0.37) PDK2
SCHEMBL19001921 0.95 PDK2 (0.37) PDK2
SCHEMBL19011224 0.94 PDK2 (0.34) PDK2
SCHEMBL24646348 0.94 PDK2 (0.34) PDK2
SCHEMBL23222532 0.94 PDK2 (0.36) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230108986-A1 ELECTRONIC DEVICE MERCK PATENT GMBH (DE) 2023-04-06 US disclosed
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