SCHEMBL28595085

SCHEMBL28595085

Cc1ccc(-c2ccc3oc4ccc(-c5cc[c]cc5)cc4c3c2)c(C)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.38
CDK9 P50750 1/20 0.38
DYRK2 Q92630 1/20 0.38
GRIA2 P42262 1/20 0.34
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TGFBR1 P36897 1/20 0.31
PIM1 P11309 1/20 0.31
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
PIM3 Q86V86 1/20 0.31
PIM2 Q9P1W9 1/20 0.31

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
SCHEMBL28596708 0.84 CDK9 (0.35) DYRK1ACDK9DYRK2GRIA2GAA
SCHEMBL28594945 0.81 PRMT5 (0.40) DYRK1ACDK9DYRK2GAAL3MBTL1
SCHEMBL28608527 0.79 TGFBR1 (0.33) DYRK1ACDK9DYRK2GRIA2GAA
SCHEMBL2039890 0.77 CCR1 (0.36) GRIA2ALDH1A1KDM4ERAB9A
SCHEMBL28594323 0.76 HAVCR2 (0.38) DYRK1ACDK9DYRK2ALDH1A1MAPT
SCHEMBL28590587 0.74 DYRK1A (0.45) DYRK1AMAPT
SCHEMBL10324400 0.72 MAPT (0.50) ALDH1A1KDM4ENPC1HPGDRAB9A
SCHEMBL28590548 0.72 ATM (0.37) DYRK1ACDK9DYRK2PIM1PIM3
SCHEMBL28599537 0.72 NPC1 (0.38) DYRK1ACDK9DYRK2GAAL3MBTL1
SCHEMBL28596704 0.70 CYP2A6 (0.40) DYRK1ACDK9DYRK2GRIA2GAA

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 1 patent. 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