SCHEMBL21295853

SCHEMBL21295853

[c]1ccc(-c2ccncc2)c2oc3ccccc3c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.37
LMNA P02545 5/20 0.36
HSD17B10 Q99714 3/20 0.36
ALDH1A1 P00352 3/20 0.36
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 3/20 0.36
POLB P06746 2/20 0.36
HPGD P15428 2/20 0.36
MAPK1 P28482 2/20 0.36
IMPDH2 P12268 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP11B1 P15538 2/20 0.36
CYP11B2 P19099 2/20 0.36
CYP17A1 P05093 1/20 0.36
CYP19A1 P11511 1/20 0.36
HTT P42858 3/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
CFTR P13569 2/20 0.35
MEN1 O00255 2/20 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
SCHEMBL21295872 0.88 CDC14B (0.42) LMNAHSD17B10ALDH1A1KMT2AKDM4E
SCHEMBL21295641 0.85 CYP11B1 (0.42) LMNAHSD17B10ALDH1A1KMT2AKDM4E
SCHEMBL21295918 0.79 ALOX5 (0.38) MAPK14LMNAHSD17B10ALDH1A1KMT2A
SCHEMBL28701250 0.75 ALOX5 (0.39) LMNAHSD17B10ALDH1A1KDM4EHPGD
SCHEMBL21296099 0.75 LMNA (0.39) MAPK14LMNAHSD17B10ALDH1A1KMT2A
SCHEMBL21295707 0.72 ALOX5 (0.38) MAPK14LMNAHSD17B10ALDH1A1KMT2A
SCHEMBL21295668 0.71 ALDH1A1 (0.38) LMNAHSD17B10ALDH1A1KMT2AKDM4E
SCHEMBL12613043 0.71 ALOX5 (0.54) MAPK14LMNAHSD17B10ALDH1A1KMT2A
SCHEMBL21019638 0.70 CDC14B (0.40) MAPK14LMNAHSD17B10ALDH1A1KMT2A
SCHEMBL21879638 0.70 ALOX5 (0.40) MAPK14LMNAHSD17B10ALDH1A1KMT2A

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