SCHEMBL22330106

SCHEMBL22330106

c1ccc(-c2nc(-c3cccc4c3oc3cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c34)nc(-c3cccc4c3sc3ccccc34)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 7/20 0.41
PIK3CD O00329 2/20 0.41
PIK3CB P42338 2/20 0.41
ALOX5 P09917 1/20 0.39
BRD4 O60885 1/20 0.37
PIK3CA P42336 1/20 0.37
MTOR P42345 1/20 0.37
PIK3CG P48736 1/20 0.37
KCNH2 Q12809 1/20 0.37
BRDT Q58F21 1/20 0.37
MAPT P10636 5/20 0.36
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
POLB P06746 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
LIMK1 P53667 2/20 0.34
PARP14 Q460N5 1/20 0.34
TSHR P16473 3/20 0.33
HPGD P15428 2/20 0.33
MAPK1 P28482 2/20 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
SCHEMBL22329580 1.00 PRKDC (0.41) PRKDCPIK3CDPIK3CBALOX5BRD4
SCHEMBL25627795 0.99 PRKDC (0.40) PRKDCPIK3CDPIK3CBALOX5BRD4
SCHEMBL24215907 0.98 PRKDC (0.41) PRKDCPIK3CDPIK3CBALOX5BRD4
SCHEMBL24215870 0.97 PRKDC (0.42) PRKDCPIK3CDPIK3CBALOX5BRD4
SCHEMBL24216050 0.97 PRKDC (0.44) PRKDCPIK3CDPIK3CBALOX5BRD4
SCHEMBL24215853 0.95 ALOX5 (0.40) PRKDCPIK3CDPIK3CBALOX5BRD4
SCHEMBL21425009 0.95 ALOX5 (0.43) PRKDCPIK3CDPIK3CBALOX5BRD4
SCHEMBL24217160 0.95 PRKDC (0.45) PRKDCPIK3CDPIK3CBALOX5BRD4
SCHEMBL24230717 0.95 PRKDC (0.43) PRKDCPIK3CDPIK3CBALOX5BRD4
SCHEMBL22329677 0.95 ALOX5 (0.38) PRKDCPIK3CDPIK3CBALOX5BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11581494-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-02-14 US disclosed
US-20200259098-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2020-08-13 US disclosed