SCHEMBL28500397

SCHEMBL28500397

O=C(O)c1ccc(-c2nc(-c3ccc(O)cc3)c(-c3ccc(O)cc3)[nH]2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.74
ALDH1A1 P00352 4/20 0.74
HPGD P15428 4/20 0.74
GLA P06280 3/20 0.74
GAA P10253 3/20 0.74
KMT2A Q03164 3/20 0.74
MEN1 O00255 2/20 0.71
MAPK14 Q16539 5/20 0.67
MAPK13 O15264 4/20 0.67
MAPK12 P53778 4/20 0.67
MAPK11 Q15759 4/20 0.67
ALOX5 P09917 2/20 0.67
TGFBR1 P36897 2/20 0.67
PTPN1 P18031 2/20 0.67
MAPT P10636 6/20 0.66
CYP1A2 P05177 2/20 0.66
CYP2C19 P33261 2/20 0.66
GFER P55789 1/20 0.66
TP53 P04637 3/20 0.63
RAF1 P04049 3/20 0.63

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
SCHEMBL29103864 0.94 KDM4E (0.83) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL19868985 0.93 MAPK13 (0.79) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL2593317 0.89 KDM4E (0.91) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL12311111 0.89 KDM4E (0.75) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL8010209 0.87 NOX1 (0.76) KDM4EALDH1A1HPGDMAPK14MAPK13
SCHEMBL14220430 0.87 KDM4E (0.72) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL28904610 0.87 MAPK13 (0.87) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL12561714 0.87 KDM4E (0.72) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL31532964 0.85 KDM4E (0.70) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL9619859 0.84 MAPK13 (0.85) KDM4EALDH1A1HPGDGLAGAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111635361-B Fluorescent compound and preparation method and application thereof 五邑大学 2022-08-02 CN disclosed
CN-111635361-A Fluorescent compound and preparation method and application thereof 五邑大学 2020-09-08 CN disclosed