SCHEMBL25847396

SCHEMBL25847396

CC1(C)c2ccccc2Oc2cccc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)c21

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 16/20 0.35
CTSD P07339 3/20 0.33
BACE1 P56817 3/20 0.33
RARB P10826 1/20 0.32
RARG P13631 1/20 0.32
RXRA P19793 1/20 0.32

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
SCHEMBL25867758 0.93 PDK2 (0.34) PDK2CTSDBACE1
SCHEMBL25848159 0.93 PDK2 (0.34) PDK2CTSDBACE1
SCHEMBL25849165 0.92 KDM4E (0.35) PDK2CTSDBACE1RARBRARG
SCHEMBL25867816 0.92 PDK2 (0.33) PDK2CTSDBACE1
SCHEMBL25848716 0.92 MEN1 (0.32) PDK2CTSDBACE1RARBRARG
SCHEMBL25849935 0.92 KDM4E (0.38) PDK2
SCHEMBL25849428 0.90 PDK2 (0.36) PDK2CTSDBACE1RARBRARG
SCHEMBL25848427 0.87 KDM4E (0.31) CTSDBACE1
SCHEMBL25872292 0.87 PDK2 (0.36) PDK2CTSDBACE1RARBRARG
SCHEMBL25847397 0.86 PDK2 (0.37) 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