SCHEMBL30302829

SCHEMBL30302829

c1ccc(-c2coc3c2ccc2c4ccccc4ccc23)c(-c2c(-c3cccc4c5ccccc5c5ccccc5c34)ccc3cc4ccccc4cc23)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
HSD17B10 Q99714 4/20 0.41
HPGD P15428 4/20 0.41
HIF1A Q16665 3/20 0.41
MAPK1 P28482 2/20 0.41
TSHR P16473 1/20 0.41
CASP1 P29466 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ANPEP P15144 1/20 0.40
CYP1A2 P05177 5/20 0.38
ERBB2 P04626 1/20 0.38
FYN P06241 1/20 0.38
MAOA P21397 1/20 0.38
ACHE P22303 1/20 0.38
AHR P35869 1/20 0.38
CES1 P23141 1/20 0.35
CYP1B1 Q16678 2/20 0.34
DNMT1 P26358 1/20 0.34
ARSA P15289 1/20 0.34
CDC25A P30304 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
SCHEMBL30302759 0.95 ALDH1A1 (0.40) ALDH1A1HSD17B10HPGDHIF1AMAPK1
SCHEMBL30302745 0.95 ALDH1A1 (0.40) ALDH1A1HSD17B10HPGDHIF1AMAPK1
SCHEMBL30302851 0.94 ANPEP (0.38) ALDH1A1HSD17B10HPGDHIF1AMAPK1
SCHEMBL30332774 0.94 ALDH1A1 (0.39) ALDH1A1HSD17B10HPGDHIF1AMAPK1
SCHEMBL30302843 0.93 ANPEP (0.37) ALDH1A1HSD17B10HPGDHIF1AMAPK1
SCHEMBL30302842 0.93 ANPEP (0.37) ALDH1A1HSD17B10HPGDHIF1AMAPK1
SCHEMBL30302761 0.91 ALDH1A1 (0.38) ALDH1A1HSD17B10HPGDHIF1AMAPK1
SCHEMBL31122703 0.91 ALDH1A1 (0.38) ALDH1A1HSD17B10HPGDHIF1AMAPK1
SCHEMBL30302624 0.90 ANPEP (0.39) ALDH1A1HSD17B10HPGDHIF1AMAPK1
SCHEMBL30302648 0.90 ANPEP (0.39) ALDH1A1HSD17B10HPGDHIF1AMAPK1

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-2022270430-A1 MIXED POWDER, MIXTURE, AND METHOD FOR MANUFACTURING ORGANIC ELECTROLUMINESCENT ELEMENT 出光興産株式会社 2022-12-29 WO disclosed