SCHEMBL25469688

SCHEMBL25469688

c1cc(-c2nc3c4c(nc(-c5cccc(-n6c7ccccc7c7ccccc76)c5)nc4n2)-c2ccccc2-3)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PDE10A Q9Y233 1/20 0.34
▸ KMT2A Q03164 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ DUSP3 P51452 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ ADORA3 P0DMS8 2/20 0.31
▸ ADORA2A P29274 2/20 0.31
▸ ADORA1 P30542 2/20 0.31
▸ TUBB4A P04350 1/20 0.30
▸ TUBB P07437 1/20 0.30
▸ TUBA3C P0DPH7 1/20 0.30
▸ TUBA1B P68363 1/20 0.30
▸ TUBA4A P68366 1/20 0.30
▸ TUBB4B P68371 1/20 0.30
▸ TUBB3 Q13509 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
SCHEMBL25472305 0.89 KDM4E (0.39) KDM4EATML3MBTL1DUSP3ADORA3
SCHEMBL25472062 0.87 KDM4E (0.45) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL25472119 0.87 ATM (0.42) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL25469487 0.85 ATM (0.43) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL25469494 0.84 ATM (0.44) KDM4EATML3MBTL1KMT2AMEN1
SCHEMBL25472309 0.84 KDM4E (0.42) KDM4EATML3MBTL1ALDH1A1RXFP1
SCHEMBL25469759 0.84 KDM4E (0.37) KDM4EATML3MBTL1
SCHEMBL4547021 0.83 KDM4E (0.53) KDM4EATML3MBTL1PDE10AKMT2A
SCHEMBL29429803 0.83 KDM4E (0.53) KDM4EATML3MBTL1PDE10AKMT2A
SCHEMBL30309408 0.83 KDM4E (0.53) KDM4EATML3MBTL1PDE10AKMT2A

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
Send feedback