SCHEMBL25849428

SCHEMBL25849428

CC1(C)c2ccccc2-c2ccc(-c3cccc4c3C(C)(C)c3ccccc3O4)cc21

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 15/20 0.36
CTSD P07339 2/20 0.33
BACE1 P56817 2/20 0.33
DRD1 P21728 1/20 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
SCHEMBL25867823 0.91 PDK2 (0.35) PDK2CTSDBACE1
SCHEMBL25847396 0.90 PDK2 (0.35) PDK2CTSDBACE1RARBRARG
SCHEMBL25849054 0.89 PDK2 (0.33) PDK2CTSDBACE1DRD1RARB
SCHEMBL25872288 0.88 PDK2 (0.38) PDK2CTSDBACE1RARBRARG
SCHEMBL25849430 0.87 PDK2 (0.38) PDK2
SCHEMBL25849426 0.86 DRD1 (0.39) PDK2DRD1
SCHEMBL25849156 0.86 FTO (0.33) PDK2DRD1RARBRARGRXRA
SCHEMBL25871488 0.86 PDK2 (0.40) PDK2BACE1
SCHEMBL25849431 0.85 PDK2 (0.38) PDK2
SCHEMBL25872804 0.85 PDK2 (0.40) 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