SCHEMBL16613382

SCHEMBL16613382

CC1(C)c2ccccc2-c2cccc(-c3nc(-n4c5ccccc5c5ccccc54)nc4cn(-c5ccccc5)cc34)c21

nearest known ligand 0.31

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PRKCB P05771 2/20 0.31
PRKCA P17252 2/20 0.31
PRKCH P24723 2/20 0.31
PRKCE Q02156 2/20 0.31
PRKCQ Q04759 2/20 0.31
PRKCD Q05655 2/20 0.31
PGR P06401 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
SCHEMBL16613317 0.91
SCHEMBL16613318 0.82 KDM4E (0.37) KDM4EATML3MBTL1
SCHEMBL24596508 0.82 PRKCB (0.32) KDM4EATML3MBTL1PRKCBPRKCA
SCHEMBL16613293 0.82 KDM4E (0.40) KDM4EATML3MBTL1
SCHEMBL16613353 0.81 DUSP3 (0.30)
SCHEMBL16613574 0.81 KDM4E (0.31) KDM4EATML3MBTL1
SCHEMBL16613320 0.81 KDM4E (0.36) KDM4EATML3MBTL1
SCHEMBL21213726 0.80 PRKCB (0.35) KDM4EL3MBTL1PRKCBPRKCAPRKCH
SCHEMBL16613292 0.80 KDM4E (0.37) KDM4EATML3MBTL1
SCHEMBL16613254 0.80 DUSP3 (0.32)

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-2015047058-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed