SCHEMBL31179922

SCHEMBL31179922

COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]2[C@@H]1[C@@H]1O[C@@H]1[C@]21C=C(C(=O)c2ccc(O)cc2)C(=O)O1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ JUN P05412 2/20 0.54
▸ POLB P06746 1/20 0.50
▸ CTDSP1 Q9GZU7 1/20 0.50
▸ MEN1 O00255 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ STAT3 P40763 13/20 0.45
▸ HSP90AA1 P07900 2/20 0.44

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
SCHEMBL29426062 0.90 JUN (0.66) JUNPOLBCTDSP1MEN1MAPT
Epoxygaertneroside SCHEMBL29426071 0.86 POLB (0.48) JUNPOLBCTDSP1MEN1MAPT
SCHEMBL30833264 0.83 POLB (0.51) JUNPOLBCTDSP1MEN1MAPT
Dehydrogaertneroside SCHEMBL29425897 0.83 POLB (0.62) JUNPOLBCTDSP1MEN1MAPT
SCHEMBL29426167 0.78 JUN (0.50) JUNPOLBCTDSP1MEN1MAPT
SCHEMBL419101 0.78 JUN (0.50) JUNPOLBCTDSP1MEN1MAPT
Citrifolinin B Epimer A SCHEMBL31179903 0.77 POLB (0.61) JUNPOLBCTDSP1MEN1MAPT
SCHEMBL29425991 0.76 POLB (0.61) JUNPOLBCTDSP1MEN1MAPT
Dehydromethoxygaertneroside SCHEMBL31180007 0.73 POLB (0.58) JUNPOLBCTDSP1MEN1MAPT
Dehydromethoxygaertneroside SCHEMBL29426153 0.73 POLB (0.58) JUNPOLBCTDSP1MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4702037-A1 METHOD OF PRODUCING IRIDOIDS Nicoventures Trading Limited (GB) 2026-03-04 — — EP disclosed
WO-2024224085-A1 METHOD OF PRODUCING IRIDOIDS Nicoventures Trading Limited (GB) 2024-10-31 — — WO disclosed
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