SCHEMBL25845575

SCHEMBL25845575

c1ccc2c(c1)Sc1ccc(-c3ccc4c(c3)-c3ccccc3C43c4ccccc4-c4ccccc43)c3cccc-2c13

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 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
SCHEMBL25845370 0.94 TYMS (0.32)
SCHEMBL25845577 0.94 PDK2 (0.35) PDK2
SCHEMBL25845574 0.93 ALDH1A1 (0.31) PDK2
SCHEMBL25845367 0.93 KDM4E (0.35) PDK2
SCHEMBL25861178 0.92 PDK2 (0.34) PDK2
SCHEMBL25845372 0.91 PDK2 (0.32) PDK2
SCHEMBL25845476 0.90 ANPEP (0.31)
SCHEMBL25869104 0.90 PDK2 (0.36) PDK2
SCHEMBL25869579 0.90 PDK2 (0.34) PDK2
SCHEMBL25869349 0.89 PDK2 (0.35) 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