SCHEMBL25469612

SCHEMBL25469612

c1ccc2c(c1)-c1nc(-c3ccc4c5ccccc5c5ccccc5c4c3)nc3nc(-c4cccc5oc6ccccc6c45)nc-2c13

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ HPGD P15428 3/20 0.32
▸ GAA P10253 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ AHR P35869 1/20 0.31
▸ MAPT P10636 2/20 0.31
▸ CHEK2 O96017 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ CASP3 P42574 1/20 0.30
▸ SENP7 Q9BQF6 1/20 0.30
▸ SENP6 Q9GZR1 1/20 0.30
▸ HCRTR1 O43613 1/20 0.30
▸ TERT O14746 1/20 0.30
▸ HSP90AA1 P07900 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
SCHEMBL25469610 0.93 CHEK2 (0.37) ALOX5BACE1KDM4EALDH1A1HPGD
SCHEMBL25469599 0.89 ALDH1A1 (0.36) ALOX5BACE1KDM4EALDH1A1HPGD
SCHEMBL25472368 0.89 ALOX5 (0.44) ALOX5KDM4EALDH1A1HPGDGAA
SCHEMBL25472196 0.89 ALDH1A1 (0.37) ALOX5BACE1KDM4EALDH1A1HPGD
SCHEMBL25469495 0.89 MAPT (0.36) BACE1KDM4EALDH1A1HPGDGAA
SCHEMBL25469764 0.89 ALOX5 (0.37) ALOX5KDM4EALDH1A1HSD17B10MAPT
SCHEMBL26048288 0.88 ALOX5 (0.38) ALOX5BACE1KDM4EALDH1A1HPGD
SCHEMBL25469409 0.87 CNR1 (0.35) ALDH1A1HPGDGAAHSD17B10L3MBTL1
SCHEMBL25469767 0.86 CHEK2 (0.36) ALOX5KDM4EALDH1A1HPGDGAA
SCHEMBL25469605 0.86 ALDH1A1 (0.39) KDM4EALDH1A1HPGDGAAHSD17B10

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-2023082808-A1 TETRAAZA-FLUORANTHENE COMPOUND AND APPLICATION THEREOF 上海八亿时空先进材料有限公司 2023-05-19 — — WO disclosed
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