SCHEMBL25872736

SCHEMBL25872736

CC1(C)c2ccccc2Oc2ccc(-c3ccc(-c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3)cc21

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 10/20 0.33
BACE1 P56817 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
SCHEMBL25847500 0.95 CTSD (0.32) PDK2BACE1
SCHEMBL25871482 0.94 PDK2 (0.33) PDK2BACE1
SCHEMBL25872729 0.93 KDM4E (0.36)
SCHEMBL25872734 0.92 PDK2 (0.32) PDK2
SCHEMBL25872730 0.92 BACE1 (0.31) PDK2BACE1
SCHEMBL25870912 0.91 PDK2 (0.32) PDK2BACE1
SCHEMBL25872731 0.91 BACE1 (0.32) PDK2BACE1
SCHEMBL25872810 0.90 PDK2 (0.32) PDK2
SCHEMBL25872284 0.90 CTSD (0.31) PDK2BACE1
SCHEMBL25871005 0.90 PDK2 (0.35) PDK2BACE1

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