SCHEMBL25850425

SCHEMBL25850425

c1ccc2c(c1)oc1cccc(-c3nc(-c4cc5oc6ccccc6c5c5ccccc45)nc(-c4cccc5oc6ccccc6c45)n3)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 8/20 0.39
▸ ALDH1A1 P00352 7/20 0.39
▸ KDM4E B2RXH2 7/20 0.39
▸ HSD17B10 Q99714 5/20 0.39
▸ GAA P10253 3/20 0.39
▸ MAPT P10636 6/20 0.37
▸ MAOA P21397 4/20 0.37
▸ CASP1 P29466 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ GLA P06280 1/20 0.37
▸ PGAM1 P18669 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ MGAM O43451 1/20 0.36
▸ SI P14410 1/20 0.36
▸ MGAM2 Q2M2H8 1/20 0.36

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
SCHEMBL25851132 0.93 ALDH1A1 (0.46) HPGDALDH1A1KDM4EHSD17B10GAA
SCHEMBL25850562 0.93 MAPT (0.39) HPGDALDH1A1KDM4EHSD17B10GAA
SCHEMBL15501671 0.91 ALDH1A1 (0.43) HPGDALDH1A1KDM4EHSD17B10GAA
SCHEMBL25508090 0.91 BACE1 (0.39) HPGDALDH1A1KDM4EHSD17B10GAA
SCHEMBL25850885 0.90 MAPT (0.38) HPGDALDH1A1KDM4EHSD17B10MAPT
SCHEMBL25660666 0.90 L3MBTL1 (0.39) HPGDALDH1A1KDM4EHSD17B10GAA
SCHEMBL25850426 0.88 BRDT (0.37) HPGDALDH1A1KDM4EHSD17B10GAA
SCHEMBL25850424 0.88 L3MBTL1 (0.38) HPGDALDH1A1KDM4EHSD17B10GAA
SCHEMBL25850427 0.88 ENPP3 (0.39) HPGDALDH1A1KDM4EHSD17B10GAA
SCHEMBL21149108 0.87 ALDH1A1 (0.46) HPGDALDH1A1KDM4EHSD17B10GAA

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
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