SCHEMBL31376205

SCHEMBL31376205

COc1cccc(/C=C/C(=O)c2ccc3c(c2O)C=CC(C)(C)O3)c1OC

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HIF1AN Q9NWT6 10/20 0.66
▸ ODC1 P11926 2/20 0.66
▸ ACHE P22303 2/20 0.64
▸ BCHE P06276 1/20 0.60
▸ PTPN1 P18031 1/20 0.60
▸ BACE1 P56817 1/20 0.60
▸ HSP90AA1 P07900 1/20 0.56

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
SCHEMBL31376228 0.91 HIF1AN (0.69) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL31376223 0.91 HIF1AN (0.69) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL31376208 0.85 NFKB1 (0.54) HIF1ANODC1ACHEHSP90AA1
SCHEMBL16694586 0.85 HIF1AN (0.72) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL16694587 0.85 HIF1AN (0.72) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL31376273 0.82 ACHE (0.73) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL16865504 0.82 HIF1AN (0.68) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL31376175 0.81 ACHE (0.66) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL16694388 0.80 HIF1AN (0.87) HIF1ANODC1ACHEBCHEPTPN1
SCHEMBL31376176 0.80 HIF1AN (0.87) HIF1ANODC1ACHEBCHEPTPN1

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-119504685-A Benzopyran flavonoid compound, preparation method and application thereof, and pharmaceutical preparation 南开大学 2025-02-25 — — CN disclosed
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