SCHEMBL14139261

SCHEMBL14139261

COc1ccc(COC(=O)c2ccc3c(c2)C=CC(C)(C)O3)cc1OC

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ COXFA4 O00483 1/20 0.81
▸ HIF1A Q16665 17/20 0.55
▸ EPAS1 Q99814 14/20 0.55
▸ HSP90AA1 P07900 1/20 0.53
▸ EP300 Q09472 1/20 0.48

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
SCHEMBL14098881 0.92 COXFA4 (0.74) COXFA4HIF1AEPAS1HSP90AA1EP300
SCHEMBL12315602 0.89 COXFA4 (0.84) COXFA4HIF1AEPAS1HSP90AA1EP300
SCHEMBL14139185 0.89 COXFA4 (1.00) COXFA4HIF1AEPAS1HSP90AA1
SCHEMBL14098877 0.86 COXFA4 (0.89) COXFA4HIF1AEPAS1HSP90AA1
SCHEMBL16694415 0.85 HIF1A (0.66) COXFA4HIF1AEPAS1HSP90AA1EP300
SCHEMBL16694306 0.82 HIF1A (0.62) COXFA4HIF1AEPAS1HSP90AA1
SCHEMBL16694172 0.82 COXFA4 (0.59) COXFA4HIF1AEPAS1HSP90AA1EP300
SCHEMBL12315469 0.82 COXFA4 (0.66) COXFA4HIF1AEPAS1EP300
SCHEMBL14139406 0.80 KMT2A (0.59) COXFA4HIF1AEPAS1HSP90AA1
SCHEMBL27665986 0.78 COXFA4 (0.57) COXFA4HIF1AEPAS1

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-7410998-B2 Inhibitors of NADH:ubiquinone oxidoreductase THE SCRIPPS RESEARCH INSTITUTE (US) 2008-08-12 — — US disclosed
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