Sugi Predict

Sugi Predict / Compounds / SCHEMBL15857417

SCHEMBL15857417

SCHEMBL15857417

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5cc6c7ccc8c(ccn8-c8ccccc8)c7n(-c7ccccc7)c6cc54)c3)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.37
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ MEN1 O00255 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ PTGER4 P35408 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ CTDSP1 Q9GZU7 1/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.31

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
SCHEMBL15857288 1.00 KDM4E (0.37) KDM4EATML3MBTL1MEN1GAA
SCHEMBL15857402 0.98 KDM4E (0.35) KDM4EATML3MBTL1
SCHEMBL15857419 0.98 KDM4E (0.35) KDM4EATML3MBTL1
SCHEMBL15857446 0.97 KDM4E (0.38) KDM4EATML3MBTL1MEN1GAA
SCHEMBL15857372 0.95 KDM4E (0.36) KDM4EATML3MBTL1MEN1GAA
SCHEMBL15857470 0.94 KDM4E (0.35) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL15857346 0.94 KDM4E (0.35) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL20427223 0.94 KDM4E (0.37) KDM4EATML3MBTL1MEN1GAA
SCHEMBL15748840 0.94 KDM4E (0.37) KDM4EATML3MBTL1MEN1GAA
SCHEMBL15857289 0.94 KDM4E (0.38) KDM4EATML3MBTL1KMT2APTGER4

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-2014104663-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 (KR) 2014-07-03 — — WO disclosed
Send feedback