SCHEMBL16482127

SCHEMBL16482127

c1ccc(-c2cccc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4c5oc6cc(-c7ccccc7)ccc6c5ccc43)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.38
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.35
BRCA1 P38398 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PRKDC P78527 2/20 0.32
EDNRB P24530 1/20 0.32
EDNRA P25101 1/20 0.32
TSPO P30536 1/20 0.32
HDAC4 P56524 1/20 0.32
ALOX5 P09917 1/20 0.31
JAK2 O60674 1/20 0.31
JAK3 P52333 1/20 0.31
WNK1 Q9H4A3 1/20 0.30
DYRK1A Q13627 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
SCHEMBL16482147 0.94 KDM4E (0.39) ATMKDM4EL3MBTL1ALDH1A1MEN1
SCHEMBL19652915 0.91 KDM4E (0.39) ATMKDM4EL3MBTL1ALDH1A1MEN1
SCHEMBL17759723 0.91 KDM4E (0.39) ATMKDM4EL3MBTL1ALDH1A1MEN1
SCHEMBL16482368 0.91 KDM4E (0.38) ATMKDM4EL3MBTL1ALDH1A1MEN1
SCHEMBL19653660 0.91 KDM4E (0.38) ATMKDM4EL3MBTL1ALDH1A1MEN1
SCHEMBL19678246 0.91 KDM4E (0.38) ATMKDM4EL3MBTL1ALDH1A1MEN1
SCHEMBL19132145 0.90 KDM4E (0.40) ATMKDM4EL3MBTL1ALDH1A1MEN1
SCHEMBL19652682 0.90 KDM4E (0.40) ATMKDM4EL3MBTL1ALDH1A1MEN1
SCHEMBL16482081 0.90 L3MBTL1 (0.40) ATMKDM4EL3MBTL1ALDH1A1MEN1
SCHEMBL24676604 0.90 KDM4E (0.39) ATMKDM4EL3MBTL1ALDH1A1MEN1

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-2014057659-A1 COMPOUND, AND ORGANIC ELECTROLUMINESCENT ELEMENT PRODUCED USING SAME 出光興産株式会社 (JP) 2014-04-17 WO disclosed