Demethylwedelolactone

Demethylwedelolactone

SCHEMBL31146849

O=c1oc2cc(O)cc(O)c2c2oc3cc(O)c(O)cc3c12

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.72
KMT2A Q03164 4/20 0.72
RECQL P46063 3/20 0.72
BLM P54132 3/20 0.72
THRB P10828 2/20 0.72
TDP1 Q9NUW8 2/20 0.72
SLC22A2 O15244 1/20 0.72
SLC22A1 O15245 1/20 0.72
EED O75530 1/20 0.72
ALOX5 P09917 1/20 0.72
G6PD P11413 1/20 0.72
CBR1 P16152 1/20 0.72
APEX1 P27695 1/20 0.72
MAOA P21397 5/20 0.62
MMP1 P03956 1/20 0.62
PTPN1 P18031 1/20 0.62
FASN P49327 1/20 0.62
KDM4E B2RXH2 3/20 0.60
MAPT P10636 3/20 0.60
GAA P10253 3/20 0.60

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
Demethylwedelolactone SCHEMBL3364302 1.00 MEN1 (0.72) MEN1KMT2ARECQLBLMTHRB
SCHEMBL517478 0.86 ESR1 (0.74) MEN1KMT2ARECQLBLMTHRB
Wedelolactone SCHEMBL29802384 0.84 MEN1 (1.00) MEN1KMT2ARECQLBLMTHRB
Wedelolactone SCHEMBL601220 0.84 MEN1 (1.00) MEN1KMT2ARECQLBLMTHRB
Wedelolactone SCHEMBL30669739 0.84 MEN1 (1.00) MEN1KMT2ARECQLBLMTHRB
SCHEMBL26970361 0.83 MEN1 (0.67) MEN1KMT2ARECQLBLMTHRB
SCHEMBL30645542 0.83 MEN1 (0.67) MEN1KMT2ARECQLBLMTHRB
SCHEMBL15870375 0.81 KMT2A (0.82) MEN1KMT2ARECQLBLMTHRB
SCHEMBL30056952 0.81 MEN1 (0.60) MEN1KMT2ARECQLBLMTHRB
SCHEMBL29603115 0.77 ESR2 (0.74) MEN1KMT2ARECQLBLMTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118924903-A Application of PI3K/Akt signal pathway agonist in preparation of medicine for treating blood deficiency 清华德人西安幸福制药有限公司 2024-11-12 CN disclosed
CN-118903430-A Application of PI3K/Akt in preparing medicament for preventing, relieving or treating blood deficiency 清华德人西安幸福制药有限公司 2024-11-08 CN disclosed
CN-118903173-A Pharmaceutical composition, pharmaceutical preparation and application 清华德人西安幸福制药有限公司 2024-11-08 CN disclosed
CN-118903109-A Application of active ingredient in preparation of Akt signal pathway agonist 清华德人西安幸福制药有限公司 2024-11-08 CN disclosed
CN-118903263-A Application of shengxuebao preparation in preparing medicament for relieving or inhibiting kidney inflammatory reaction 清华德人西安幸福制药有限公司 2024-11-08 CN disclosed