SCHEMBL27317536

SCHEMBL27317536

CC(C)(C)c1ccc2c(c1)C1(c3cc(C(C)(C)C)ccc3S2)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)C3(c5ccccc5Oc5ccccc53)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
SCHEMBL27317538 0.96 PDK2 (0.31) PDK2
SCHEMBL27318352 0.95 PDK2 (0.35) PDK2
SCHEMBL27318515 0.93 PDK2 (0.34) PDK2
SCHEMBL27318512 0.93 PDK2 (0.34) PDK2
SCHEMBL27317537 0.93 PDK2 (0.35) PDK2
SCHEMBL27312364 0.93
SCHEMBL27318517 0.91 PDK2 (0.35) PDK2
SCHEMBL27317651 0.91 PDK2 (0.34) PDK2
SCHEMBL27318527 0.91 PDK2 (0.34) PDK2
SCHEMBL27316397 0.91 PDK2 (0.32) 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-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