SCHEMBL23819369

SCHEMBL23819369

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5cc(-c6cccc7ccc8c9ccccc9sc8c67)ccc5c34)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 3/20 0.41
ALOX5 P09917 1/20 0.40
LIMK1 P53667 1/20 0.33
S1PR5 Q9H228 7/20 0.33
S1PR4 O95977 6/20 0.33
SLC9A1 P19634 1/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
MAPK1 P28482 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL27361604 0.94 PRKDC (0.41) PRKDCALOX5S1PR5S1PR4SLC9A1
SCHEMBL23819657 0.93 PRKDC (0.43) PRKDCALOX5LIMK1S1PR5S1PR4
SCHEMBL24216599 0.93 PRKDC (0.48) PRKDCALOX5LIMK1SLC9A1MAPT
SCHEMBL24123410 0.93 ALOX5 (0.36) PRKDCALOX5LIMK1MAPTKDM4E
SCHEMBL24216461 0.92 PRKDC (0.47) PRKDCALOX5LIMK1SLC9A1MAPT
SCHEMBL24216339 0.92 PRKDC (0.47) PRKDCALOX5LIMK1SLC9A1MAPT
SCHEMBL24216464 0.92 PRKDC (0.47) PRKDCALOX5LIMK1MAPTPIK3CD
SCHEMBL22329531 0.92 PRKDC (0.44) PRKDCALOX5LIMK1SLC9A1MAPT
SCHEMBL24314512 0.91 PRKDC (0.44) PRKDCALOX5S1PR5S1PR4MAPT
SCHEMBL23349784 0.91 PRKDC (0.46) PRKDCALOX5LIMK1MAPTKDM4E

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-2021182833-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-09-16 WO disclosed