SCHEMBL17990571

SCHEMBL17990571

c1ccc(-c2nc(-n3c4ccccc4c4cc5c(cc43)c3c4ccccc4ccc3n5-c3ccccc3)nc3ccccc23)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.42
HPGD P15428 3/20 0.42
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 4/20 0.41
LMNA P02545 1/20 0.40
ATM Q13315 2/20 0.39
NUDT1 P36639 3/20 0.35
ADORA2A P29274 2/20 0.35
MAPK1 P28482 2/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 3/20 0.34
PTGES O14684 1/20 0.34
MEN1 O00255 2/20 0.33
IL1R1 P14778 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL17117639 1.00 KDM4E (0.42) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL17990566 0.97 KDM4E (0.41) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL19507612 0.97 KDM4E (0.41) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL16542830 0.95 KDM4E (0.41) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL16785813 0.95 KDM4E (0.41) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL808392 0.94 KDM4E (0.41) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL21152022 0.94 KDM4E (0.41) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL16542859 0.93 KDM4E (0.40) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL21168744 0.93 ALDH1A1 (0.40) KDM4EALDH1A1HPGDMAPTNPSR1
SCHEMBL16542862 0.92 ALDH1A1 (0.39) KDM4EALDH1A1HPGDMAPTNPSR1

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-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 US disclosed