SCHEMBL17039512

SCHEMBL17039512

c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4nc(-c5ccc(-c6cccc7ccccc67)cc5)c5ccccn45)ccc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.38
▸ ATM Q13315 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ RORC P51449 2/20 0.33
▸ ENPP3 O14638 1/20 0.33
▸ ENPP1 P22413 1/20 0.33
▸ TLR4 O00206 1/20 0.33
▸ PTGER4 P35408 1/20 0.33
▸ RAD51 Q06609 2/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ NPY5R Q15761 1/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ POLB P06746 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL17039497 0.94 KDM4E (0.36) KDM4EATML3MBTL1RORCENPP3
SCHEMBL17039385 0.94 KDM4E (0.39) KDM4EATML3MBTL1RORCENPP3
SCHEMBL17039529 0.92 KDM4E (0.38) KDM4EATML3MBTL1TLR4PTGER4
SCHEMBL17039398 0.90 KDM4E (0.44) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL17039527 0.89 KDM4E (0.43) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL17039372 0.89 ENPP3 (0.40) KDM4ERORCENPP3ENPP1RAD51
SCHEMBL17039515 0.87 KDM4E (0.41) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL17039498 0.86 RAD51 (0.44) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL17039517 0.85 KDM4E (0.41) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL23370382 0.83 KDM4E (0.51) KDM4EATML3MBTL1ENPP3ENPP1

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-2015126161-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 — — WO disclosed
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