SCHEMBL24417322

SCHEMBL24417322

c1ccc(-c2nc(-c3ccc4c(c3)oc3ccccc34)nc(-c3ccccc3-n3c4ccccc4c4ccc5oc6c(-c7ccccc7)cccc6c5c43)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 2/20 0.38
ALOX5 P09917 2/20 0.36
MAPT P10636 4/20 0.32
KDM4E B2RXH2 2/20 0.32
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 1/20 0.32
POLB P06746 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GGPS1 O95749 1/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
PIK3CG P48736 1/20 0.31

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
SCHEMBL24417240 0.93 PRKDC (0.32) PRKDCALOX5KDM4ETSHRHSD17B10
SCHEMBL25953190 0.93 PRKDC (0.39) PRKDCALOX5MAPTKDM4ETSHR
SCHEMBL24417323 0.93 PRKDC (0.31) PRKDCALOX5KDM4ETSHRHSD17B10
SCHEMBL24417284 0.92 PRKDC (0.33) PRKDCALOX5MAPTKDM4ETSHR
SCHEMBL24417236 0.92 PRKDC (0.33) PRKDCALOX5MAPTKDM4ETSHR
SCHEMBL24417238 0.92 PRKDC (0.33) PRKDCALOX5MAPTKDM4ETSHR
SCHEMBL27445422 0.92 PRKDC (0.35) PRKDCALOX5MAPTKDM4ETSHR
SCHEMBL24417237 0.92 PRKDC (0.33) PRKDCMAPTKDM4ETSHRLMNA
SCHEMBL27445448 0.91 PRKDC (0.35) PRKDCALOX5MAPTKDM4ETSHR
SCHEMBL27445409 0.91 PRKDC (0.35) PRKDCALOX5MAPTKDM4ETSHR

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
US-20220149289-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2022-05-12 US disclosed