SCHEMBL21295865

SCHEMBL21295865

Cc1[c]ccc2c1oc1ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.40
AHR P35869 1/20 0.40
KDM4E B2RXH2 6/20 0.39
ALDH1A1 P00352 5/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
ALOX5 P09917 2/20 0.38
MAPT P10636 2/20 0.38
LIMK1 P53667 1/20 0.38
CYP2C19 P33261 1/20 0.37
MAOA P21397 4/20 0.36
HPGD P15428 2/20 0.36
GLA P06280 1/20 0.36
CYP3A4 P08684 1/20 0.36
PGAM1 P18669 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PPARG P37231 1/20 0.36

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
SCHEMBL28508069 0.77 MAPT (0.39) PGRAHRKDM4EALDH1A1MEN1
SCHEMBL21295829 0.76 KDM4E (0.42) AHRKDM4EALDH1A1MEN1KMT2A
SCHEMBL28563984 0.75 ALOX5 (0.42) AHRKDM4EALDH1A1MEN1KMT2A
SCHEMBL21295668 0.73 ALDH1A1 (0.38) AHRKDM4EALDH1A1MEN1KMT2A
SCHEMBL1635471 0.73 AHR (0.52) PGRAHRKDM4EALDH1A1MEN1
SCHEMBL13564032 0.73 AHR (0.52) PGRAHRKDM4EALDH1A1MEN1
SCHEMBL12108 0.72 ALOX5 (0.46) PGRAHRKDM4EALDH1A1MEN1
SCHEMBL21295769 0.70 LMNA (0.42) AHRKDM4EALDH1A1MEN1KMT2A
SCHEMBL21296099 0.70 LMNA (0.39) AHRKDM4EALDH1A1MEN1KMT2A
SCHEMBL12880855 0.69 PGR (0.53) PGRAHRKDM4EALDH1A1MEN1

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