SCHEMBL25850426

SCHEMBL25850426

c1ccc2c(c1)oc1cccc(-c3nc(-c4cc5oc6ccccc6c5c5ccccc45)nc(-c4cccc5sc6ccccc6c45)n3)c12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRDT Q58F21 1/20 0.37
▸ GAA P10253 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ GPR3 P46089 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ DUSP3 P51452 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ PTPN5 P54829 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ PTPN11 Q06124 1/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ CTDSP1 Q9GZU7 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ ELANE P08246 1/20 0.31
▸ ESR1 P03372 1/20 0.30

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
SCHEMBL25850893 0.90 HCRTR1 (0.33) BRDT
SCHEMBL25850425 0.88 HPGD (0.39) GAAKDM4EALDH1A1HPGDHSD17B10
SCHEMBL19802388 0.87 MAPT (0.36) BRDTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL25501246 0.87 BRDT (0.34) BRDTGAAKDM4EALDH1A1HPGD
SCHEMBL23820291 0.86 BRDT (0.36) BRDTGAAKDM4EALDH1A1HPGD
SCHEMBL25504716 0.86 BRDT (0.34) BRDTGAAKDM4EALDH1A1HPGD
SCHEMBL21148704 0.86 ALOX5 (0.39) BRDTGAAKDM4EALDH1A1HPGD
SCHEMBL26435266 0.86 TDP1 (0.40) BRDTGAAKDM4EALDH1A1HPGD
SCHEMBL25503181 0.86 BRDT (0.34) BRDTTDP1
SCHEMBL23283960 0.85 S1PR5 (0.38) BRDTALDH1A1MAPTTDP1

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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