SCHEMBL31493379

SCHEMBL31493379

CC1(C)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc21

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PDK2 Q15119 3/20 0.36
PGR P06401 2/20 0.32
HDAC4 P56524 1/20 0.31
MAPK8 P45983 1/20 0.31
ALK Q9UM73 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
SCHEMBL401420 1.00 KDM4E (0.41) KDM4EATML3MBTL1PDK2PGR
SCHEMBL17722209 0.97 KDM4E (0.39) KDM4EATML3MBTL1PDK2PGR
SCHEMBL22507366 0.97 KDM4E (0.39) KDM4EATML3MBTL1PDK2PGR
SCHEMBL13620206 0.96 KDM4E (0.38) KDM4EATML3MBTL1PDK2PGR
SCHEMBL12704818 0.96 KDM4E (0.38) KDM4EATML3MBTL1PDK2PGR
SCHEMBL10029885 0.96 KDM4E (0.36) KDM4EATML3MBTL1PDK2PGR
SCHEMBL13518235 0.96 KDM4E (0.44) KDM4EATML3MBTL1PDK2PGR
SCHEMBL29373577 0.96 KDM4E (0.44) KDM4EATML3MBTL1PDK2PGR
SCHEMBL1593388 0.96 KDM4E (0.44) KDM4EATML3MBTL1PDK2PGR
SCHEMBL31862 0.95 KDM4E (0.40) KDM4EATML3MBTL1PDK2PGR

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
CN-107814821-B Metal complexes with dibenzo [ F, H ] quinoxalines UDC 爱尔兰有限责任公司 2025-03-07 CN disclosed