SCHEMBL31376256

SCHEMBL31376256

COc1cc2c(c(O)c1C(=O)/C=C/c1ccccc1O)C=CC(C)(C)O2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.54
▸ MAOB P27338 1/20 0.54
▸ ODC1 P11926 4/20 0.54
▸ HIF1AN Q9NWT6 2/20 0.54
▸ NFKB1 P19838 1/20 0.53
▸ NFKB2 Q00653 1/20 0.53
▸ RELA Q04206 1/20 0.53
▸ ACHE P22303 2/20 0.48
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ MAPT P10636 3/20 0.45
▸ NPSR1 Q6W5P4 3/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ PLIN1 O60240 1/20 0.45
▸ POLB P06746 1/20 0.45

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
SCHEMBL31376186 0.93 NFKB1 (0.54) MAOAMAOBODC1HIF1ANNFKB1
SCHEMBL31376219 0.90 NFKB1 (0.51) MAOAMAOBODC1HIF1ANNFKB1
SCHEMBL31376246 0.90 ABCG2 (0.55) MAOAMAOBODC1HIF1ANNFKB1
SCHEMBL31376208 0.88 NFKB1 (0.54) MAOBODC1HIF1ANNFKB1NFKB2
SCHEMBL31376253 0.88 NFKB1 (0.62) ODC1HIF1ANNFKB1NFKB2RELA
SCHEMBL31376278 0.86 NFKB1 (0.53) ODC1HIF1ANNFKB1NFKB2RELA
SCHEMBL31376194 0.85 NFKB1 (0.54) ODC1HIF1ANNFKB1NFKB2RELA
SCHEMBL31376262 0.84 HIF1AN (0.75) ODC1HIF1ANNFKB1NFKB2RELA
SCHEMBL31376261 0.84 ODC1 (0.75) ODC1HIF1ANNFKB1NFKB2RELA
SCHEMBL14315437 0.84 HIF1AN (0.67) ODC1HIF1ANNFKB1NFKB2RELA

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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