SCHEMBL22329639

SCHEMBL22329639

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(c4)oc4c(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)cccc45)cc3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.45
PRKDC P78527 2/20 0.41
MAPT P10636 5/20 0.38
ALDH1A1 P00352 4/20 0.38
KDM4E B2RXH2 3/20 0.38
HPGD P15428 3/20 0.38
TSHR P16473 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ATM Q13315 2/20 0.38
TP53 P04637 1/20 0.38
NFKB1 P19838 1/20 0.38
MAPK1 P28482 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HSD17B1 P14061 1/20 0.38
HSD17B2 P37059 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL20739659 1.00 ALOX5 (0.45) ALOX5PRKDCMAPTALDH1A1KDM4E
SCHEMBL25645842 1.00 ALOX5 (0.45) ALOX5PRKDCMAPTALDH1A1KDM4E
SCHEMBL25626999 1.00 ALOX5 (0.45) ALOX5PRKDCMAPTALDH1A1KDM4E
SCHEMBL22884277 1.00 ALOX5 (0.45) ALOX5PRKDCMAPTALDH1A1KDM4E
SCHEMBL24216487 1.00 ALOX5 (0.45) ALOX5PRKDCMAPTALDH1A1KDM4E
SCHEMBL25645841 1.00 ALOX5 (0.45) ALOX5PRKDCMAPTALDH1A1KDM4E
SCHEMBL24216408 1.00 ALOX5 (0.45) ALOX5PRKDCMAPTALDH1A1KDM4E
SCHEMBL24216741 1.00 ALOX5 (0.45) ALOX5PRKDCMAPTALDH1A1KDM4E
SCHEMBL24217105 0.99 ALOX5 (0.44) ALOX5PRKDCMAPTALDH1A1KDM4E
SCHEMBL22883841 0.99 ALOX5 (0.44) ALOX5PRKDCMAPTALDH1A1KDM4E

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