SCHEMBL19286788

SCHEMBL19286788

COc1ccc(C(C)C(=O)c2ccc3c(c2O)C=CC(C)(C)O3)cc1OC

nearest known ligand 0.82

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 9/20 0.82
▸ HSP90AA1 P07900 4/20 0.57
▸ HIF1AN Q9NWT6 4/20 0.56
▸ ODC1 P11926 1/20 0.54
▸ ACHE P22303 1/20 0.50

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
SCHEMBL16694382 0.90 HIF1A (1.00) HIF1AHSP90AA1
SCHEMBL16694335 0.90 HIF1A (1.00) HIF1AHSP90AA1
SCHEMBL16694336 0.90 HIF1A (1.00) HIF1AHSP90AA1
SCHEMBL16867649 0.87 HIF1A (0.66) HIF1AHSP90AA1HIF1ANODC1
SCHEMBL16694376 0.87 HIF1A (0.66) HIF1AHSP90AA1HIF1ANODC1
SCHEMBL16694375 0.87 HIF1A (0.66) HIF1AHSP90AA1HIF1ANODC1
SCHEMBL19365716 0.86 HIF1A (0.76) HIF1AHSP90AA1
SCHEMBL16865493 0.82 HIF1A (0.84) HIF1AHSP90AA1
SCHEMBL16865494 0.82 HIF1A (0.84) HIF1AHSP90AA1
SCHEMBL16865550 0.82 HIF1A (0.84) HIF1AHSP90AA1

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
US-9745280-B2 Compound or pharmaceutically acceptable salt thereof, and pharmaceutical composition containing same as active ingredient SNU R&DB FOUNDATION (KR) 2017-08-29 — — US disclosed
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