SCHEMBL22876474

SCHEMBL22876474

c1ccc(-c2nc(-c3cccc4oc5ccccc5c34)nc(-c3cccc4oc5ccc(-c6ccc7c8c(cccc68)-c6ccccc6-7)cc5c34)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.36
PLA2G4A P47712 3/20 0.36
PLA2G10 O15496 1/20 0.36
ALOX5 P09917 1/20 0.34
ALDH1A1 P00352 5/20 0.34
HPGD P15428 4/20 0.34
TSHR P16473 4/20 0.34
MAPT P10636 4/20 0.34
MAPK1 P28482 2/20 0.34
HSD17B10 Q99714 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ATM Q13315 2/20 0.34
TP53 P04637 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CASP1 P29466 1/20 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
SCHEMBL21741749 0.99 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10ALOX5ALDH1A1
SCHEMBL21741973 0.98 PLA2G2A (0.37) PLA2G2APLA2G4APLA2G10ALOX5ALDH1A1
SCHEMBL22876473 0.96 ALOX5 (0.36) PLA2G2APLA2G4APLA2G10ALOX5ALDH1A1
SCHEMBL21741738 0.95 PLA2G2A (0.39) PLA2G2APLA2G4APLA2G10ALOX5ALDH1A1
SCHEMBL19802304 0.94 ALOX5 (0.35) PLA2G2APLA2G4APLA2G10ALOX5ALDH1A1
SCHEMBL21741699 0.94 PLA2G2A (0.39) PLA2G2APLA2G4APLA2G10ALDH1A1HPGD
SCHEMBL21741833 0.94 PLA2G2A (0.39) PLA2G2APLA2G4APLA2G10ALDH1A1HPGD
SCHEMBL22876369 0.94 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10ALOX5ALDH1A1
SCHEMBL24930289 0.94 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10ALOX5ALDH1A1
SCHEMBL24930261 0.94 ALDH1A1 (0.36) PLA2G2APLA2G4APLA2G10ALOX5ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11685859-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-06-27 US disclosed
US-11685859-B2 Organic light emitting device LG CHEM, LTD. (KR) 2023-06-27 US disclosed
US-20210009894-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2021-01-14 US disclosed