SCHEMBL27322679

SCHEMBL27322679

CC(C)(C)c1ccc2c(c1)C1(c3cc(C(C)(C)C)ccc3S2)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3O4)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 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
SCHEMBL27322680 1.00 PDK2 (0.31) PDK2
SCHEMBL27322676 1.00 PDK2 (0.31) PDK2
SCHEMBL27318509 0.98 PDK2 (0.32) PDK2
SCHEMBL27322673 0.98 PDK2 (0.32) PDK2
SCHEMBL27322678 0.98 PDK2 (0.32) PDK2
SCHEMBL27321745 0.96 PDK2 (0.31) PDK2
SCHEMBL27322936 0.96
SCHEMBL27319780 0.95 PDK2 (0.30) PDK2
SCHEMBL27318512 0.94 PDK2 (0.34) PDK2
SCHEMBL27320141 0.94

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-2024071062-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2024-04-04 WO disclosed