SCHEMBL13534952

SCHEMBL13534952

COc1ccc(/C=C/C(=O)c2ccc3c(c2O)C=CC(C)(C)O3)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 1.00
▸ ODC1 P11926 2/20 0.80
▸ PTPN1 P18031 2/20 0.80
▸ BCHE P06276 1/20 0.80
▸ BACE1 P56817 1/20 0.80
▸ HIF1AN Q9NWT6 12/20 0.74

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
SCHEMBL31376270 1.00 ACHE (1.00) ACHEODC1PTPN1BCHEBACE1
SCHEMBL19960679 0.89 PTPN1 (1.00) ACHEODC1PTPN1BCHEBACE1
SCHEMBL31376263 0.89 PTPN1 (1.00) ACHEODC1PTPN1BCHEBACE1
SCHEMBL19960678 0.88 PTPN1 (0.85) ACHEODC1PTPN1BCHEBACE1
SCHEMBL31376190 0.88 ACHE (0.78) ACHEODC1PTPN1BCHEBACE1
SCHEMBL31376191 0.87 PTPN1 (0.83) ACHEODC1PTPN1BCHEBACE1
Lonchocarpin SCHEMBL29435870 0.86 PTPN1 (0.83) ACHEODC1PTPN1BCHEBACE1
SCHEMBL16694388 0.86 HIF1AN (0.87) ACHEODC1PTPN1BCHEBACE1
SCHEMBL31376176 0.86 HIF1AN (0.87) ACHEODC1PTPN1BCHEBACE1
SCHEMBL16694389 0.86 HIF1AN (0.87) ACHEODC1PTPN1BCHEBACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112390774-B Chalcone compound and preparation method thereof from ranunculus spinosus 山东省分析测试中心 2022-05-17 — — CN claimed
CN-106905281-A Suppress flavone compound of acetyl and butyrylcholine esterase and application thereof in thick fruit precipice beans rattan 四川大学 2017-06-30 — — CN claimed
CN-112390774-B Chalcone compound and preparation method thereof from ranunculus spinosus 山东省分析测试中心 2022-05-17 — — CN disclosed
CN-114031592-A Chalcone derivative, preparation thereof and application thereof in preparation of antitumor drugs or functional foods 山东省分析测试中心 2022-02-11 — — CN disclosed
CN-112274505-B Application of chalcone compound in preparation of medicine for treating Alzheimer disease and pharmaceutical composition 山东省分析测试中心 2022-01-04 — — CN disclosed
CN-112402411-B Application of chalcone compound in preparation of sleep improvement medicine 山东省分析测试中心 2021-09-21 — — CN disclosed
CN-112402411-A Application of chalcone compound in preparation of sleep improvement medicine 山东省分析测试中心 2021-02-26 — — CN disclosed
CN-112390774-A Chalcone compound and preparation method thereof from ranunculus spinosus 山东省分析测试中心 2021-02-23 — — CN disclosed
CN-112274505-A Application of chalcone compound in preparation of medicine for treating Alzheimer disease and pharmaceutical composition 山东省分析测试中心 2021-01-29 — — CN disclosed
CN-106905281-B Inhibit acetyl and the flavone compound of butyrylcholine esterase and application thereof in thick fruit precipice beans rattan 四川大学 2019-10-08 — — CN disclosed
CN-106905281-A Suppress flavone compound of acetyl and butyrylcholine esterase and application thereof in thick fruit precipice beans rattan 四川大学 2017-06-30 — — CN disclosed
WO-2010006189-A2 SMALL-MOLECULE INHIBITORS OF HIF AND ANGIOGENESIS EMORY UNIVERSITY (US) 2010-01-14 — — WO disclosed
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