SCHEMBL17864170

SCHEMBL17864170

c1ccc(-n2c3ccncc3c3cc(-n4c5ccccc5c5ccc6ccc7c8ccccc8ccc7c6c54)ccc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAOA P21397 4/20 0.35
MAOB P27338 4/20 0.35
ACHE P22303 1/20 0.35
TOP2A P11388 1/20 0.32
CDK4 P11802 1/20 0.32
CDK6 Q00534 1/20 0.32
CYP2D6 P10635 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 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
SCHEMBL17864187 0.94 KDM4E (0.41) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL17864173 0.90 KDM4E (0.46) KDM4EATML3MBTL1MAOAACHE
SCHEMBL17864123 0.89 KDM4E (0.38) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL26329940 0.88 KDM4E (0.38) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL26329916 0.87 KDM4E (0.43) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL26329936 0.87 KDM4E (0.43) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL26329911 0.87 KDM4E (0.43) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL17245332 0.87 KDM4E (0.47) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL17864060 0.86 KDM4E (0.40) KDM4EATML3MBTL1MAOAMAOB
SCHEMBL17864131 0.86 KDM4E (0.40) KDM4EATML3MBTL1MAOAMAOB

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-2016099037-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2016-06-23 WO disclosed