SCHEMBL21295787

SCHEMBL21295787

[c]1ccc2oc3ccc(-c4ccccc4)cc3c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 5/20 0.45
PLA2G4A P47712 5/20 0.45
PLA2G10 O15496 1/20 0.39
PGR P06401 1/20 0.39
PRKDC P78527 3/20 0.39
GAA P10253 2/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTPN1 P18031 2/20 0.37
PTPN2 P17706 1/20 0.37
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TBK1 Q9UHD2 1/20 0.36
MAP4K4 O95819 1/20 0.35

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
SCHEMBL21295849 0.89 PLA2G2A (0.44) PLA2G2APLA2G4APLA2G10PGRPRKDC
SCHEMBL21295967 0.89 MMP12 (0.40) PLA2G2APLA2G4APLA2G10PGRPRKDC
SCHEMBL21300551 0.84 DYRK1A (0.41) MAPTMAP4K4
SCHEMBL1784272 0.84 PLA2G2A (0.58) PLA2G2APLA2G4APLA2G10PGRPRKDC
SCHEMBL21151721 0.84 PLA2G2A (0.58) PLA2G2APLA2G4APLA2G10PGRPRKDC
SCHEMBL14295997 0.84 PLA2G2A (0.58) PLA2G2APLA2G4APLA2G10PGRPRKDC
SCHEMBL21295953 0.82 PGR (0.45) PGRMEN1MAPTALDH1A1TBK1
SCHEMBL1635672 0.80 PLA2G2A (0.55) PLA2G2APLA2G4APLA2G10PGRPRKDC
SCHEMBL1635801 0.80 PLA2G2A (0.55) PLA2G2APLA2G4APLA2G10PGRPRKDC
SCHEMBL1637168 0.80 PLA2G2A (0.55) PLA2G2APLA2G4APLA2G10PGRPRKDC

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109311844-B Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component 东曹株式会社 2021-07-20 CN disclosed
CN-112912372-A Cyclic azine compound, material for organic electroluminescent element, electron transport material for organic electroluminescent element, and organic electroluminescent element 东曹株式会社 2021-06-04 CN disclosed
WO-2020085319-A1 CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ELECTRON TRANSPORT MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2020-04-30 WO disclosed
WO-2019163959-A1 CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCNET ELEMENT, AND ELECTRON-TRANSPORTING MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2019-08-29 WO disclosed