SCHEMBL19061306

SCHEMBL19061306

CC1(C)c2ccccc2-c2ccc(-c3cccc(-c4cccc5c6ccccc6n(-c6cc(-c7ccccc7)cc(-c7ccccc7)c6)c45)c3)cc21

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 13/20 0.36
▸ DUSP3 P51452 1/20 0.34
▸ CAMK2D Q13557 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ GSK3B P49841 1/20 0.30
▸ RXRA P19793 1/20 0.30
▸ RXRB P28702 1/20 0.30
▸ PDE10A Q9Y233 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
SCHEMBL19061336 0.98 PDK2 (0.36) PDK2DUSP3CAMK2DKDM4EATM
SCHEMBL19061308 0.96 PDK2 (0.36) PDK2DUSP3CAMK2DKDM4EATM
SCHEMBL19061700 0.95 DUSP3 (0.34) PDK2DUSP3KDM4EATML3MBTL1
SCHEMBL19061861 0.94 KDM4E (0.36) PDK2DUSP3CAMK2DKDM4EATM
SCHEMBL19061305 0.93 L3MBTL1 (0.38) PDK2DUSP3KDM4EATML3MBTL1
SCHEMBL19061864 0.93 PDK2 (0.32) PDK2DUSP3KDM4E
SCHEMBL19061329 0.92 PDK2 (0.36) PDK2DUSP3KDM4EATML3MBTL1
SCHEMBL19061304 0.91 PDK2 (0.34) PDK2DUSP3KDM4EPDE10A
SCHEMBL19061696 0.91 PDK2 (0.32) PDK2DUSP3KDM4EL3MBTL1
SCHEMBL19061863 0.91 PRKDC (0.35) PDK2DUSP3

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-2017111389-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DIODE INCLUDING SAME 주식회사 두산 2017-06-29 — — WO disclosed
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