SCHEMBL21296041

SCHEMBL21296041

[c]1cc(-c2ccccc2)c2oc3ccccc3c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.42
AHR P35869 1/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CSF1R P07333 1/20 0.41
PDGFRB P09619 1/20 0.41
KIT P10721 1/20 0.41
FLT3 P36888 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
CDC14B O60729 1/20 0.40
CDC14A Q9UNH5 1/20 0.40
ADORA3 P0DMS8 2/20 0.39
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
CYP3A4 P08684 3/20 0.38
CA12 O43570 2/20 0.38
TP53 P04637 2/20 0.38
ABCB1 P08183 2/20 0.38
AR P10275 2/20 0.38

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
SCHEMBL21295707 0.87 ALOX5 (0.38) ALOX5AHRMAPTMEN1KMT2A
SCHEMBL21295959 0.84 CYP11B1 (0.43) ALOX5MAPTMEN1KMT2ACYP3A4
SCHEMBL11712766 0.78 ALOX5 (0.63) ALOX5AHRMAPTMEN1KMT2A
SCHEMBL21412957 0.77 ALOX5 (0.46) ALOX5AHRMAPTMEN1KMT2A
SCHEMBL29828999 0.77 ALOX5 (0.46) ALOX5AHRMAPTMEN1KMT2A
SCHEMBL21295929 0.76 NPC1 (0.40) ALOX5AHRMAPTMEN1KMT2A
SCHEMBL28571958 0.76 CDC14B (0.40) AHRMAPTMEN1KMT2ACSF1R
SCHEMBL21295800 0.76 ALOX5 (0.46) ALOX5MAPTMEN1KMT2ACSF1R
SCHEMBL21431853 0.75 ALOX5 (0.59) ALOX5AHRMAPTMEN1KMT2A
SCHEMBL16182153 0.75 ALOX5 (0.57) ALOX5AHRMAPTMEN1KMT2A

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