SCHEMBL21296099

SCHEMBL21296099

[c]1ccc2c(oc3ccccc32)c1-c1ccncc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.39
KMT2A Q03164 4/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
HTT P42858 2/20 0.39
MEN1 O00255 2/20 0.39
USP2 O75604 1/20 0.39
ALOX5 P09917 1/20 0.38
JAK2 O60674 1/20 0.38
ZAP70 P43403 1/20 0.38
SYK P43405 1/20 0.38
MAPK14 Q16539 1/20 0.38
ALDH1A1 P00352 5/20 0.37
KDM4E B2RXH2 5/20 0.37
HPGD P15428 3/20 0.37
HSD17B10 Q99714 3/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
LIMK1 P53667 1/20 0.36
MAPT P10636 3/20 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
SCHEMBL28563984 0.87 ALOX5 (0.42) LMNAKMT2ANPC1RAB9AMEN1
SCHEMBL21295769 0.79 LMNA (0.42) LMNAKMT2ANPC1RAB9AHTT
SCHEMBL21295853 0.75 MAPK14 (0.37) LMNAKMT2ANPC1RAB9AHTT
SCHEMBL21295865 0.70 PGR (0.40) LMNAKMT2ANPC1RAB9AMEN1
SCHEMBL21295707 0.70 ALOX5 (0.38) LMNAKMT2ANPC1RAB9AHTT
SCHEMBL12613043 0.69 ALOX5 (0.54) LMNAKMT2ANPC1RAB9AHTT
SCHEMBL11811328 0.68 PLAU (0.34) LMNANPC1RAB9AHSD17B10MAPT
SCHEMBL24493114 0.68 ALOX5 (0.52) LMNANPC1RAB9AALOX5JAK2
SCHEMBL12613380 0.68 ALOX5 (0.52) LMNAKMT2ANPC1RAB9AHTT
SCHEMBL21295971 0.68 ALOX5 (0.40) LMNANPC1RAB9AHTTALOX5

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