SCHEMBL25844246

SCHEMBL25844246

c1ccc(-c2cccc(-c3nc(-c4ccc(-c5ccc6c7c(cccc57)-c5ccccc5-6)cc4)nc(-c4cccc5oc6ccccc6c45)n3)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.38
PLA2G4A P47712 3/20 0.38
PLA2G10 O15496 1/20 0.36
MAPT P10636 5/20 0.34
ALDH1A1 P00352 4/20 0.34
L3MBTL1 Q9Y468 4/20 0.34
TSHR P16473 3/20 0.34
HPGD P15428 3/20 0.34
KDM4E B2RXH2 2/20 0.34
MAPK1 P28482 2/20 0.34
HSD17B10 Q99714 2/20 0.34
ATM Q13315 2/20 0.34
SMN1; SMN2 Q16637 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
TDP1 Q9NUW8 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34

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
SCHEMBL24930289 0.96 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL24930302 0.96 MAPT (0.36) MAPTALDH1A1L3MBTL1TSHRHPGD
SCHEMBL24930286 0.95 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL24930305 0.95 MAPT (0.37) MAPTALDH1A1L3MBTL1TSHRHPGD
SCHEMBL21741699 0.94 PLA2G2A (0.39) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL21741833 0.94 PLA2G2A (0.39) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL24930261 0.94 ALDH1A1 (0.36) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL24930849 0.94 PLA2G2A (0.37) PLA2G2APLA2G4APLA2G10MAPTALDH1A1
SCHEMBL25823521 0.94 BACE1 (0.36) PLA2G2APLA2G4AMAPTALDH1A1L3MBTL1
SCHEMBL21741738 0.93 PLA2G2A (0.39) PLA2G2APLA2G4APLA2G10MAPTALDH1A1

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-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed