SCHEMBL21755976

SCHEMBL21755976

C1=Cc2c(oc3cccc(-c4nc(-c5ccccc5)nc(-c5ccc6c(c5)oc5ccc(-c7ccc8c9ccccc9c9ccccc9c8c7)cc56)n4)c23)CC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.33
PLA2G4A P47712 3/20 0.33
PLA2G10 O15496 1/20 0.33
MMP12 P39900 1/20 0.31
CHEK2 O96017 1/20 0.30
HCRTR1 O43613 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
SCHEMBL24971407 0.93 PLA2G2A (0.31) PLA2G2APLA2G4APLA2G10HCRTR1
SCHEMBL26028073 0.92
SCHEMBL24314490 0.89 PLA2G2A (0.33) PLA2G2APLA2G4APLA2G10
SCHEMBL22924259 0.88 PLA2G2A (0.37) PLA2G2APLA2G4APLA2G10MMP12CHEK2
SCHEMBL22924336 0.88 PLA2G2A (0.32) PLA2G2APLA2G4APLA2G10MMP12CHEK2
SCHEMBL25653245 0.88 HCRTR1 (0.33) HCRTR1
SCHEMBL27279016 0.87 PLA2G2A (0.30) PLA2G2APLA2G4A
SCHEMBL24972108 0.87 PLA2G2A (0.32) PLA2G2APLA2G4A
SCHEMBL24315150 0.87 HCRTR1 (0.32) HCRTR1
SCHEMBL25848343 0.86 PLA2G2A (0.35) PLA2G2APLA2G4APLA2G10

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-2020040571-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-02-27 WO disclosed