SCHEMBL13372144

SCHEMBL13372144

CC1(C)C2=C(C=CCC2)c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(/C=C/c5ccc(-c6ccc(N(c7ccc(-c8ccccc8)cc7)c7ccc8c(c7)C(C)(C)c7ccccc7-8)cc6)cc5)cc4)cc3)cc21

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.30

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
SCHEMBL13371981 0.98 PDK2 (0.30) PDK2
SCHEMBL22106444 0.94 PDK2 (0.30) PDK2
SCHEMBL13371972 0.93 PDK2 (0.35) PDK2
SCHEMBL13371940 0.93 PDK2 (0.35) PDK2
SCHEMBL13371914 0.92 PDK2 (0.33) PDK2
SCHEMBL9886721 0.92 PDK2 (0.32) PDK2
SCHEMBL1755513 0.92 PDK2 (0.30) PDK2
SCHEMBL13371912 0.92 — —
SCHEMBL13371949 0.91 — —
SCHEMBL19650756 0.90 PDK2 (0.31) 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-2010058995-A1 ELECTROLUMINESCENT DEVICE USING THE ELECTROLUMINESCENT COMPOUNDS GRACEL DISPLAY INC. (KR) 2010-05-27 — — WO disclosed
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