SCHEMBL21295786

SCHEMBL21295786

[c]1cc2oc3ccccc3c2cc1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
HPGD P15428 4/20 0.44
KDM4E B2RXH2 4/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 3/20 0.44
NPC1 O15118 3/20 0.44
AHR P35869 3/20 0.44
RAB9A P51151 2/20 0.44
CYP3A4 P08684 3/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA12 O43570 2/20 0.41
TP53 P04637 2/20 0.41
ABCB1 P08183 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
AR P10275 2/20 0.41
CYP1B1 Q16678 2/20 0.41
CA9 Q16790 2/20 0.41

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
SCHEMBL21300530 0.87 MAPT (0.40) MAPTHPGDKDM4EMEN1KMT2A
SCHEMBL21295911 0.76 NPC1 (0.44) MAPTHPGDKDM4EMEN1KMT2A
SCHEMBL21295695 0.75 MAPT (0.47) MAPTHPGDKDM4EMEN1KMT2A
SCHEMBL5367660 0.75 MAPT (0.47) MAPTHPGDKDM4EMEN1KMT2A
SCHEMBL8964749 0.75 MAPT (0.47) MAPTHPGDKDM4EMEN1KMT2A
Dibenzofuran SCHEMBL6389356 0.74 MAPT (0.56) MAPTHPGDKDM4EMEN1KMT2A
SCHEMBL21296090 0.74 KDM4E (0.43) MAPTHPGDKDM4EMEN1KMT2A
SCHEMBL20277362 0.72 PLA2G2A (0.60) MAPTHPGDKDM4EMEN1KMT2A
SCHEMBL20706686 0.72 PLA2G2A (0.60) MAPTHPGDKDM4EMEN1KMT2A
SCHEMBL13991440 0.72 PLA2G2A (0.60) MAPTHPGDKDM4EMEN1KMT2A

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