SCHEMBL21425901

SCHEMBL21425901

C1=CC(c2ccc3oc4ccccc4c3c2)=CC(c2cccc(-c3ccc4oc5ccccc5c4c3)c2)C1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 4/20 0.36
PLA2G4A P47712 4/20 0.36
PLA2G10 O15496 1/20 0.36
NPC1 O15118 4/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
AHR P35869 2/20 0.33
CASP3 P42574 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
PDE10A Q9Y233 2/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL23783995 0.86 CDK1 (0.34) PLA2G2APLA2G4APLA2G10PRKDC
SCHEMBL22421894 0.84 PRKDC (0.33) PLA2G2APLA2G4APLA2G10PRKDC
SCHEMBL12811299 0.81 PLA2G2A (0.32) PLA2G2APLA2G4APLA2G10PRKDC
SCHEMBL17573761 0.79 PLA2G2A (0.35) PLA2G2APLA2G4APLA2G10NPC1SMN1; SMN2
SCHEMBL20984022 0.78 CDK1 (0.35) PLA2G2APLA2G4APLA2G10PRKDC
SCHEMBL22541769 0.76 GABRP (0.38) PLA2G2APLA2G4APLA2G10NPC1SMN1; SMN2
SCHEMBL15855190 0.73 PLA2G2A (0.57) PLA2G2APLA2G4APLA2G10NPC1SMN1; SMN2
SCHEMBL15836068 0.73 PLA2G2A (0.57) PLA2G2APLA2G4APLA2G10NPC1SMN1; SMN2
SCHEMBL15836011 0.73 PLA2G2A (0.57) PLA2G2APLA2G4APLA2G10NPC1SMN1; SMN2
SCHEMBL15855167 0.73 PLA2G2A (0.57) PLA2G2APLA2G4APLA2G10NPC1SMN1; SMN2

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-2019190223-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2019-10-03 WO disclosed