SCHEMBL16482137

SCHEMBL16482137

c1ccc(-c2cccc3c4ccccc4n(-c4cccc5c6c7sc8ccccc8c7ccc6n(-c6ccccc6)c45)c23)cc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
ALOX5 P09917 1/20 0.33
LIMK1 P53667 1/20 0.32
F9 P00740 1/20 0.31
DUSP3 P51452 1/20 0.31
PRKDC P78527 1/20 0.31
HSD17B10 Q99714 1/20 0.30
MAPK14 Q16539 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
SCHEMBL16482393 0.90 ATM (0.41) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL16482193 0.89 ALOX5 (0.42) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL16482294 0.89 ALOX5 (0.38) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL16482334 0.88 TNKS (0.35) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL16482158 0.88 ALOX5 (0.43) TNKSTNKS2ALOX5PRKDC
SCHEMBL16482292 0.86 TNKS (0.36) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL16482140 0.86 KDM4E (0.37) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL16482499 0.85 TNKS (0.36) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL16482497 0.85 TNKS (0.36) KDM4EATML3MBTL1TNKSTNKS2
SCHEMBL16482494 0.85 TNKS (0.36) KDM4EATML3MBTL1TNKSTNKS2

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