SCHEMBL25867951

SCHEMBL25867951

CC1(C)c2ccccc2Oc2cc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cc5ccccc5cc3-4)ccc21

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 19/20 0.35
CYP3A4 P08684 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
SCHEMBL25848516 0.96 CYP3A4 (0.32) PDK2CYP3A4
SCHEMBL25864154 0.95 PDK2 (0.35) PDK2CYP3A4
SCHEMBL25848160 0.94 PDK2 (0.36) PDK2
SCHEMBL25848428 0.93 PDK2 (0.33) PDK2
SCHEMBL25872806 0.93 PDK2 (0.38) PDK2
SCHEMBL25848170 0.92 PDK2 (0.37) PDK2
SCHEMBL25864079 0.92 PDK2 (0.37) PDK2
SCHEMBL25847398 0.92 PDK2 (0.36) PDK2CYP3A4
SCHEMBL25868020 0.91 PDK2 (0.33) PDK2
SCHEMBL25871492 0.91 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