SCHEMBL29008532

SCHEMBL29008532

CC(=O)Oc1c(O)cc2oc(-c3ccccc3)cc(=O)c2c1OC(C)=O

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CREB1 P16220 6/20 0.86
▸ PRSS1 P07477 2/20 0.67
▸ PRSS2 P07478 2/20 0.67
▸ PRSS3 P35030 2/20 0.67
▸ SLCO2B1 O94956 2/20 0.67
▸ FLT3 P36888 1/20 0.67
▸ PTPRS Q13332 2/20 0.65
▸ ABCB1 P08183 8/20 0.61
▸ CYP3A4 P08684 4/20 0.61
▸ MAPT P10636 4/20 0.61
▸ CYP2C9 P11712 3/20 0.61
▸ CYP2C19 P33261 3/20 0.61
▸ MEN1 O00255 3/20 0.61
▸ ALDH1A1 P00352 3/20 0.61
▸ CYP1A1 P04798 3/20 0.61
▸ CYP1A2 P05177 3/20 0.61
▸ KMT2A Q03164 3/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.61
▸ CYP1B1 Q16678 3/20 0.61
▸ FTO Q9C0B1 3/20 0.61

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
SCHEMBL22966699 0.93 CREB1 (0.82) CREB1PRSS1PRSS2PRSS3SLCO2B1
SCHEMBL972407 0.93 CREB1 (1.00) CREB1PRSS1PRSS2PRSS3SLCO2B1
SCHEMBL972738 0.90 CREB1 (0.70) CREB1PRSS1PRSS2PRSS3SLCO2B1
SCHEMBL972837 0.86 CREB1 (0.80) CREB1PRSS1PRSS2PRSS3SLCO2B1
SCHEMBL970007 0.85 CREB1 (0.65) CREB1PRSS1PRSS2PRSS3SLCO2B1
SCHEMBL21224157 0.85 MAPT (0.74) CREB1SLCO2B1FLT3ABCB1CYP3A4
SCHEMBL29494596 0.85 MAPT (0.74) CREB1SLCO2B1FLT3ABCB1CYP3A4
SCHEMBL8064245 0.84 CREB1 (0.83) CREB1PRSS1PRSS2PRSS3SLCO2B1
SCHEMBL974333 0.84 ABCB1 (0.68) CREB1PRSS1PRSS2PRSS3SLCO2B1
SCHEMBL971180 0.84 CREB1 (0.66) CREB1PRSS1PRSS2PRSS3SLCO2B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111303106-B Preparation method of 5, 6-diacetoxy-7-hydroxy flavone 武汉轻工大学 2023-06-02 — — CN claimed
CN-111303106-A Preparation method of 5, 6-diacetoxy-7-hydroxyflavone 武汉轻工大学 2020-06-19 — — CN claimed
CN-111303106-B Preparation method of 5, 6-diacetoxy-7-hydroxy flavone 武汉轻工大学 2023-06-02 — — CN disclosed
CN-111303106-B Preparation method of 5, 6-diacetoxy-7-hydroxy flavone 武汉轻工大学 2023-06-02 — — CN disclosed
CN-111303106-B Preparation method of 5, 6-diacetoxy-7-hydroxy flavone 武汉轻工大学 2023-06-02 — — CN disclosed
CN-111303106-A Preparation method of 5, 6-diacetoxy-7-hydroxyflavone 武汉轻工大学 2020-06-19 — — CN disclosed
CN-111303106-A Preparation method of 5, 6-diacetoxy-7-hydroxyflavone 武汉轻工大学 2020-06-19 — — CN disclosed
CN-111303106-A Preparation method of 5, 6-diacetoxy-7-hydroxyflavone 武汉轻工大学 2020-06-19 — — CN disclosed
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