SCHEMBL19001839

SCHEMBL19001839

CC1(C)c2ccccc2-c2cc3c(cc21)N(c1cccc2c1-c1ccccc1C21c2ccccc2-c2ccc(-c4ccccc4)cc21)c1ccccc1C3(C)C

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 6/20 0.34
PGR P06401 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
SCHEMBL19001836 0.92 PDK2 (0.38) PDK2PGR
SCHEMBL19001815 0.92 PDK2 (0.39) PDK2PGR
SCHEMBL19001828 0.92 PDK2 (0.39) PDK2PGR
SCHEMBL16810737 0.89 PDK2 (0.36) PDK2PGR
SCHEMBL17816797 0.89 PDK2 (0.36) PDK2PGR
SCHEMBL15213627 0.89 PDK2 (0.37) PDK2PGR
SCHEMBL17816793 0.89 PGR (0.33) PGR
SCHEMBL23222627 0.84
SCHEMBL19042757 0.83 PDK2 (0.39) PDK2PGR
SCHEMBL25121505 0.83 PDE6D (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 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