SCHEMBL25865308

SCHEMBL25865308

CC1(c2ccccc2)c2cc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3c(ccc5ccccc35)O4)ccc2-c2cc3ccccc3cc21

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.31
BACE1 P56817 1/20 0.30

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
SCHEMBL25852124 0.95 PDK2 (0.30) PDK2
SCHEMBL25865251 0.90
SCHEMBL25865253 0.90 PDK2 (0.33) PDK2BACE1
SCHEMBL25851412 0.88 PDK2 (0.33) PDK2
SCHEMBL25865148 0.88 PDK2 (0.33) PDK2
SCHEMBL25856761 0.88 KDM4E (0.35) PDK2BACE1
SCHEMBL25866483 0.87 PDK2 (0.34) PDK2BACE1
SCHEMBL25864350 0.87 PDK2 (0.31) PDK2
SCHEMBL25865143 0.87 PDK2 (0.32) PDK2BACE1
SCHEMBL25857625 0.87 KDM4E (0.30) 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
WO-2023120714-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-06-29 WO disclosed