SCHEMBL28432225

SCHEMBL28432225

O=c1c(O)c(-c2cc(O)cc(O)c2)oc2cc(O)cc(O)c12

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.85
▸ KMT2A Q03164 8/20 0.85
▸ CYP1A2 P05177 8/20 0.85
▸ CYP1A1 P04798 7/20 0.85
▸ CYP1B1 Q16678 7/20 0.85
▸ CYP3A4 P08684 6/20 0.85
▸ CYP2C9 P11712 6/20 0.85
▸ FTO Q9C0B1 6/20 0.85
▸ XDH P47989 6/20 0.85
▸ MAPT P10636 5/20 0.85
▸ KDM4E B2RXH2 5/20 0.85
▸ ALOX15 P16050 5/20 0.85
▸ HSD17B10 Q99714 5/20 0.85
▸ APP P05067 5/20 0.85
▸ BCHE P06276 4/20 0.85
▸ CYP2D6 P10635 4/20 0.85
▸ ACHE P22303 4/20 0.85
▸ CYP2C19 P33261 4/20 0.85
▸ HIF1A Q16665 4/20 0.85
▸ ALDH1A1 P00352 4/20 0.85

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
Myricetin SCHEMBL29357150 0.92 MEN1 (1.00) MEN1KMT2ACYP1A2CYP1A1CYP1B1
Myricetin SCHEMBL19302 0.92 MEN1 (1.00) MEN1KMT2ACYP1A2CYP1A1CYP1B1
Myricetin SCHEMBL3503992 0.92 MEN1 (1.00) MEN1KMT2ACYP1A2CYP1A1CYP1B1
SCHEMBL22738241 0.90 MEN1 (0.78) MEN1KMT2ACYP1A2CYP1A1CYP1B1
SCHEMBL15197351 0.88 MEN1 (0.81) MEN1KMT2ACYP1A2CYP1A1CYP1B1
Kaempferol SCHEMBL1259228 0.87 MEN1 (1.00) MEN1KMT2ACYP1A2CYP1A1CYP1B1
Kaempferol SCHEMBL30655455 0.87 MEN1 (1.00) MEN1KMT2ACYP1A2CYP1A1CYP1B1
Kaempferol SCHEMBL29378805 0.87 MEN1 (1.00) MEN1KMT2ACYP1A2CYP1A1CYP1B1
Kaempferol SCHEMBL18817 0.87 MEN1 (1.00) MEN1KMT2ACYP1A2CYP1A1CYP1B1
SCHEMBL12203895 0.86 MEN1 (0.78) MEN1KMT2ACYP1A2CYP1A1CYP1B1

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-111450139-A Eutectic solvent and method for preparing spina gleditsiae total flavonoids by using same 山东省分析测试中心 2020-07-28 — — CN disclosed
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