SCHEMBL22058828

SCHEMBL22058828

c1ccc(-c2ccc3oc4cc(-c5ccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)cc5-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)ccc4c3c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 3/20 0.38
▸ PLA2G4A P47712 3/20 0.38
▸ GAA P10253 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ MMP12 P39900 2/20 0.37
▸ PIM1 P11309 1/20 0.37
▸ CSNK2A2 P19784 1/20 0.37
▸ CSNK2B P67870 1/20 0.37
▸ PIM3 Q86V86 1/20 0.37
▸ PIM2 Q9P1W9 1/20 0.37
▸ MMP13 P45452 1/20 0.36
▸ TBK1 Q9UHD2 1/20 0.36
▸ PGR P06401 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ HCRTR1 O43613 1/20 0.34
▸ CHEK2 O96017 1/20 0.34

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
SCHEMBL26194992 0.94 PIM1 (0.40) PLA2G2APLA2G4AGAAL3MBTL1MMP12
SCHEMBL26194988 0.94 PIM1 (0.40) PLA2G2APLA2G4AGAAL3MBTL1MMP12
SCHEMBL22058840 0.94 PLA2G2A (0.42) PLA2G2APLA2G4AGAAL3MBTL1PIM1
SCHEMBL15501614 0.93 PLA2G2A (0.45) PLA2G2APLA2G4AGAAL3MBTL1PIM1
SCHEMBL29311030 0.92 HSD17B1 (0.38) PLA2G2APLA2G4AGAAL3MBTL1MMP12
SCHEMBL26195112 0.92 PLA2G2A (0.44) PLA2G2APLA2G4AGAAL3MBTL1MMP12
SCHEMBL26195109 0.92 PLA2G2A (0.44) PLA2G2APLA2G4AGAAL3MBTL1MMP12
SCHEMBL22058012 0.92 AHR (0.41) PLA2G2APLA2G4AMMP12MMP13MEN1
SCHEMBL22058002 0.92 PLA2G2A (0.43) PLA2G2APLA2G4AGAAL3MBTL1MEN1
SCHEMBL24215964 0.92 PLA2G2A (0.44) PLA2G2APLA2G4AGAAL3MBTL1MMP12

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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