SCHEMBL16558393

SCHEMBL16558393

c1ccc(-c2c3ccc(-c4ccc5c(c4)Oc4cccc6cccc-5c46)cc3c(-c3ccccc3)c3ccc(-c4ccc5c(c4)Oc4cccc6cccc-5c46)cc23)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.54
ATM Q13315 2/20 0.54
KDM4E B2RXH2 1/20 0.54
TYMS P04818 1/20 0.40
ALDH1A1 P00352 3/20 0.33
TSHR P16473 3/20 0.33
HSD17B10 Q99714 3/20 0.33
HSD17B1 P14061 2/20 0.33
HSD17B2 P37059 2/20 0.33
HPGD P15428 2/20 0.33
CASP1 P29466 2/20 0.33
HIF1A Q16665 2/20 0.33
TP53 P04637 1/20 0.33
CASP7 P55210 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2B6 P20813 1/20 0.33
CYP2C19 P33261 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
SCHEMBL22969551 0.93 MAPK1 (0.55) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL16558394 0.93 KDM4E (0.50) MAPK1ATMKDM4ETYMS
SCHEMBL22971975 0.92 MAPK1 (0.54) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL22971964 0.92 MAPK1 (0.57) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL16558391 0.92 KDM4E (0.49) MAPK1ATMKDM4ETYMS
SCHEMBL22969549 0.91 MAPK1 (0.55) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL16376403 0.91 MAPK1 (0.55) MAPK1ATMKDM4ETYMSALDH1A1
SCHEMBL16558368 0.90 KDM4E (0.49) MAPK1ATMKDM4ETYMSGPR84
SCHEMBL16558380 0.90 KDM4E (0.49) MAPK1ATMKDM4ETYMSGPR84
SCHEMBL23109581 0.90 MAPK1 (0.54) MAPK1ATMKDM4ETYMSALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9601700-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-21 US disclosed
US-9601700-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-03-21 US disclosed
US-20150069344-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-12 US disclosed
US-20150069344-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-12 US disclosed