SCHEMBL21295872

SCHEMBL21295872

[c]1ccc(-c2ccccc2)c2oc3ccccc3c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC14B O60729 2/20 0.42
CDC14A Q9UNH5 2/20 0.42
MAPT P10636 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
CSF1R P07333 1/20 0.40
PDGFRB P09619 1/20 0.40
KIT P10721 1/20 0.40
FLT3 P36888 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
ALOX5 P09917 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
CA1 P00915 3/20 0.37
CA2 P00918 3/20 0.37
HPGD P15428 3/20 0.37
CYP19A1 P11511 2/20 0.37
CA12 O43570 2/20 0.37
TP53 P04637 2/20 0.37
ABCB1 P08183 2/20 0.37
CYP3A4 P08684 2/20 0.37

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
SCHEMBL21295853 0.88 MAPK14 (0.37) CDC14BCDC14AMAPTMEN1KMT2A
SCHEMBL21295641 0.84 CYP11B1 (0.42) MAPTMEN1KMT2AALOX5SMN1; SMN2
SCHEMBL28701250 0.80 ALOX5 (0.39) CDC14BCDC14AMAPTALOX5SMN1; SMN2
SCHEMBL21296149 0.79 ALOX5 (0.43) CDC14BCDC14AMAPTMEN1KMT2A
SCHEMBL21295668 0.76 ALDH1A1 (0.38) MAPTMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL11712766 0.73 ALOX5 (0.63) CDC14BCDC14AMAPTMEN1KMT2A
SCHEMBL12203192 0.73 CDC14B (0.57) CDC14BCDC14AMAPTMEN1KMT2A
SCHEMBL22188277 0.73 KDM4E (0.41) CDC14BCDC14AMAPTMEN1KMT2A
SCHEMBL5548656 0.72 ALDH1A1 (0.37) MAPTKMT2ASMN1; SMN2HPGDCYP19A1
SCHEMBL28468586 0.72 ALDH1A1 (0.39) MAPTMEN1KMT2AHDAC6SMN1; 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 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