Gaertneric Acid

Gaertneric Acid

SCHEMBL29426009

O=C(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]1C=C[C@@]21C=C(C(O)c2ccc(O)cc2)C(=O)O1

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.49
▸ CTDSP1 Q9GZU7 1/20 0.49
▸ MAPT P10636 2/20 0.41
▸ HSP90AA1 P07900 7/20 0.40
▸ XDH P47989 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ GLA P06280 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ JUN P05412 1/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ STAT3 P40763 4/20 0.35

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
Gaertneroside SCHEMBL31179982 0.93 POLB (0.60) POLBCTDSP1MAPTHSP90AA1MEN1
Gaertneroside SCHEMBL420081 0.93 POLB (0.60) POLBCTDSP1MAPTHSP90AA1MEN1
Acetylgaertneroside SCHEMBL29426176 0.84 POLB (0.49) POLBCTDSP1MAPTHSP90AA1MEN1
Methoxygaertneroside SCHEMBL29425771 0.83 POLB (0.56) POLBCTDSP1MAPTKDM4EMEN1
Methoxygaertneroside SCHEMBL29425775 0.83 POLB (0.56) POLBCTDSP1MAPTKDM4EMEN1
Plumieride SCHEMBL419720 0.81 POLB (0.65) POLBCTDSP1MAPTMEN1KMT2A
Dehydrogaertneroside SCHEMBL29425897 0.78 POLB (0.62) POLBCTDSP1MAPTHSP90AA1MEN1
Epoxygaertneroside SCHEMBL29426071 0.76 POLB (0.48) POLBCTDSP1MAPTHSP90AA1MEN1
SCHEMBL29425686 0.75 POLB (0.68) POLBCTDSP1MAPTMEN1KMT2A
SCHEMBL422339 0.74 POLB (0.80) POLBCTDSP1MAPTHSP90AA1KDM4E

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 3 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
EP-3409766-B1 AN ESTERASE THAT IS CAPABLE OF CONVERTING IRIDOIDS AND SECO-IRIDOIDS N ZYME BIOTEC GMBH (DE) 2022-03-09 — — EP disclosed
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