SCHEMBL17033541

SCHEMBL17033541

c1ccc(-n2c3ccccc3c3cc(-c4ccnc(-n5c6ccccc6c6ccc7c(nc8c9ccccc9c9ccccc9n78)c65)c4)ccc32)cc1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
PTGER4 P35408 1/20 0.32
KHK P50053 2/20 0.31
DPP4 P27487 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
GLA P06280 1/20 0.30
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
SCHEMBL17033717 0.91 PDE4A (0.36) KDM4EPDE4APDE4BPDE4CPDE4D
SCHEMBL16066178 0.86 KDM4E (0.38) KDM4EATML3MBTL1PDE4APDE4B
SCHEMBL17033742 0.85 KDM4E (0.39) KDM4EATML3MBTL1PDE4APDE4B
SCHEMBL17033673 0.84 KDM4E (0.37) KDM4EATML3MBTL1PDE4APDE4B
SCHEMBL16066505 0.84 KDM4E (0.36) KDM4EATML3MBTL1PTGER4ALDH1A1
SCHEMBL16066770 0.84 KDM4E (0.36) KDM4EATML3MBTL1PDE4APDE4B
SCHEMBL17033670 0.83 KDM4E (0.36) KDM4EATML3MBTL1PDE4APDE4B
SCHEMBL10023824 0.82 KDM4E (0.43) KDM4EATML3MBTL1PTGER4ALDH1A1
SCHEMBL16066646 0.82 KDM4E (0.36) KDM4EATML3MBTL1PDE4APDE4B
SCHEMBL10023474 0.82 KDM4E (0.45) KDM4EATML3MBTL1PTGER4ALDH1A1

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-2015125986-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 WO disclosed