SCHEMBL16613246

SCHEMBL16613246

c1ccc(-n2c3ccccc3c3cccc(-c4nc(-n5c6ccccc6c6ccccc65)nc5cscc45)c32)cc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
DUSP3 P51452 1/20 0.37
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
RECQL P46063 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL16613423 0.91 KDM4E (0.33) KDM4EATML3MBTL1DUSP3
SCHEMBL16613244 0.88 KDM4E (0.32) KDM4EATML3MBTL1DUSP3
SCHEMBL16613251 0.85 ALDH1A1 (0.35) KDM4EATML3MBTL1DUSP3HSD17B10
SCHEMBL16613240 0.84 KDM4E (0.37) KDM4EATML3MBTL1DUSP3HSD17B10
SCHEMBL16613260 0.83 TUBB4A (0.34) KDM4EDUSP3
SCHEMBL16613354 0.82 KDM4E (0.41) KDM4EATML3MBTL1DUSP3MAPK1
SCHEMBL16613293 0.81 KDM4E (0.40) KDM4EATML3MBTL1DUSP3MAPK1
SCHEMBL16613344 0.81 KDM4E (0.47) KDM4EATML3MBTL1MAPK1HSD17B10
SCHEMBL16613342 0.81 DUSP3 (0.31) DUSP3
SCHEMBL25019528 0.80 KDM4E (0.39) KDM4EATML3MBTL1DUSP3MAPK1

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-2015047058-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed