SCHEMBL21454559

SCHEMBL21454559

c1ccc2cc3c(cc2c1)oc1c3ccc2c3cc4ccccc4cc3oc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.42
PRKDC P78527 4/20 0.39
XRCC6 P12956 1/20 0.39
XRCC5 P13010 1/20 0.39
AHR P35869 4/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
CYP1B1 Q16678 2/20 0.36
HIF1A Q16665 1/20 0.36
NQO1 P15559 1/20 0.35
KDM4E B2RXH2 2/20 0.35
MAPT P10636 2/20 0.35
HPGD P15428 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
ELANE P08246 1/20 0.35
GLA P06280 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL16984719 0.96 DYRK1A (0.40) DYRK1APRKDCXRCC6XRCC5AHR
SCHEMBL5469700 0.88 KMT2A (0.49) DYRK1APRKDCALDH1A1HSD17B10CYP1B1
SCHEMBL19082483 0.86 CYP2A6 (0.42) AHRALDH1A1MAPTHPGDKMT2A
SCHEMBL29867995 0.85 AHR (0.46) PRKDCXRCC6XRCC5AHRALDH1A1
SCHEMBL903595 0.85 AHR (0.46) PRKDCXRCC6XRCC5AHRALDH1A1
SCHEMBL16807597 0.83 AHR (0.45) PRKDCXRCC6XRCC5AHRALDH1A1
SCHEMBL22740585 0.83 PRKDC (0.34) DYRK1APRKDCXRCC6XRCC5ALDH1A1
SCHEMBL21454561 0.81 PRKDC (0.45) PRKDCXRCC6XRCC5AHRALDH1A1
SCHEMBL13085338 0.81 AHR (0.43) DYRK1APRKDCXRCC6XRCC5AHR
SCHEMBL23421880 0.81 HPGD (0.45) DYRK1APRKDCAHRALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210336149-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2021-10-28 US disclosed
WO-2021065772-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC APPLIANCE 出光興産株式会社 2021-04-08 WO disclosed
WO-2021025163-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE USING SAME 出光興産株式会社 2021-02-11 WO disclosed
US-20210028365-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC APPLIANCE IDEMITSU KOSAN CO.,LTD. (JP) 2021-01-28 US disclosed
WO-2019194298-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC DEVICE 出光興産株式会社 2019-10-10 WO disclosed