SCHEMBL16282966

SCHEMBL16282966

CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5c(c4)c4cc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)ccc4n5-c4ccccc4)c3cc21

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TSPO P30536 1/20 0.31
HDAC4 P56524 1/20 0.31
RAC2 P15153 1/20 0.31
RAC3 P60763 1/20 0.31
CDC42 P60953 1/20 0.31
RAC1 P63000 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
SCHEMBL16282982 0.96 KDM4E (0.37) KDM4EATML3MBTL1
SCHEMBL14960742 0.95 KDM4E (0.35) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL22901106 0.94 KDM4E (0.35) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL16773565 0.94
SCHEMBL31711 0.94 KDM4E (0.35) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL31708 0.94 KDM4E (0.35) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL802676 0.93 KDM4E (0.33) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL31793 0.93 KDM4E (0.36) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL782432 0.93 KDM4E (0.36) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL802512 0.93

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140364625-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM & HAAS ELECT MAT (KR) 2014-12-11 US disclosed
US-20140364625-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ROHM & HAAS ELECT MAT (KR) 2014-12-11 US disclosed