SCHEMBL21300530

SCHEMBL21300530

[c]1cc2oc3ccccc3c2cc1-c1ccncc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.40
KDM4E B2RXH2 6/20 0.40
ALDH1A1 P00352 5/20 0.40
HPGD P15428 5/20 0.40
NPC1 O15118 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
HSD17B10 Q99714 3/20 0.40
RAB9A P51151 3/20 0.40
AHR P35869 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
MAPK14 Q16539 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
MAOA P21397 2/20 0.34
GLA P06280 1/20 0.34
CYP3A4 P08684 1/20 0.34
PGAM1 P18669 1/20 0.34
CASP1 P29466 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
SCHEMBL21296090 0.88 KDM4E (0.43) MAPTKDM4EALDH1A1HPGDNPC1
SCHEMBL21295786 0.87 MAPT (0.44) MAPTKDM4EALDH1A1HPGDNPC1
SCHEMBL21295911 0.78 NPC1 (0.44) MAPTKDM4EALDH1A1HPGDNPC1
SCHEMBL23331505 0.76 NPC1 (0.50) MAPTKDM4EALDH1A1HPGDNPC1
SCHEMBL23331530 0.76 NPC1 (0.50) MAPTKDM4EALDH1A1HPGDNPC1
SCHEMBL21295782 0.73 MAPK14 (0.38) MAPTKDM4EALDH1A1HPGDNPC1
SCHEMBL21295752 0.72 MAPK14 (0.40) MAPTKDM4EALDH1A1HPGDNPC1
SCHEMBL22136448 0.72 PLA2G2A (0.48) MAPTKDM4EALDH1A1HPGDNPC1
SCHEMBL22428491 0.71 PLA2G2A (0.47) MAPTKDM4EALDH1A1HPGDNPC1
SCHEMBL21295695 0.70 MAPT (0.47) MAPTKDM4EALDH1A1HPGDNPC1

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