SCHEMBL29425979

SCHEMBL29425979

O=C1OCC[C@H]2CC=C(CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]12

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.40
▸ PTPN1 P18031 2/20 0.40
▸ STAT3 P40763 1/20 0.39
▸ TYR P14679 1/20 0.38
▸ CA1 P00915 2/20 0.37
▸ CA2 P00918 2/20 0.37
▸ CA9 Q16790 2/20 0.37

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
SCHEMBL31179889 0.73 TSHR (0.31) —
SCHEMBL28280841 0.70 PTPN1 (0.56) PTPN1STAT3TYR
SCHEMBL28121333 0.70 PTPN1 (0.56) PTPN1STAT3TYR
SCHEMBL4274167 0.68 ACHE (0.49) ACHETYR
SCHEMBL14975518 0.66 SLC5A2 (0.61) ACHETYR
SCHEMBL14975517 0.66 SLC5A2 (0.61) ACHETYR
SCHEMBL16227542 0.66 SLC5A2 (0.61) ACHETYR
SCHEMBL29425907 0.65 ACHE (0.40) ACHETYR
SCHEMBL6282017 0.64 TYR (0.51) ACHETYR
SCHEMBL7065715 0.64 TYR (0.55) TYR

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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