SCHEMBL22058292

SCHEMBL22058292

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c6ccccc6n(-c6ccccc6)c5c4)c(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ ATM Q13315 2/20 0.47
▸ AVPR1A P37288 1/20 0.36
▸ KMT2A Q03164 5/20 0.35
▸ IL1R1 P14778 1/20 0.35
▸ MEN1 O00255 4/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ MAPT P10636 3/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ CTDSP1 Q9GZU7 1/20 0.35
▸ ABCG2 Q9UNQ0 1/20 0.35
▸ PTGER4 P35408 1/20 0.34
▸ MAT2A P31153 2/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ ACP1 P24666 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33

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
SCHEMBL22058818 0.99 KDM4E (0.46) KDM4EL3MBTL1ATMAVPR1AKMT2A
SCHEMBL22058774 0.96 KDM4E (0.44) KDM4EL3MBTL1ATMAVPR1AKMT2A
SCHEMBL22058886 0.96 KDM4E (0.44) KDM4EL3MBTL1ATMAVPR1AKMT2A
SCHEMBL16943248 0.96 L3MBTL1 (0.46) KDM4EL3MBTL1ATMAVPR1AKMT2A
SCHEMBL22058287 0.95 KMT2A (0.43) KDM4EL3MBTL1ATMAVPR1AKMT2A
SCHEMBL22058282 0.92 KDM4E (0.47) KDM4EL3MBTL1ATMAVPR1AKMT2A
SCHEMBL21190490 0.92 L3MBTL1 (0.50) KDM4EL3MBTL1ATMAVPR1AKMT2A
SCHEMBL17754476 0.92 L3MBTL1 (0.56) KDM4EL3MBTL1ATMAVPR1AKMT2A
SCHEMBL22058747 0.91 KDM4E (0.37) KDM4EL3MBTL1ATMAVPR1AKMT2A
SCHEMBL22058808 0.91 KDM4E (0.44) KDM4EL3MBTL1ATMAVPR1AKMT2A

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-2020111585-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-06-04 — — WO disclosed
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