SCHEMBL31179906

SCHEMBL31179906

COC1C=C(CO)C2C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)C12

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.60
▸ MAPT P10636 2/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ PTPN1 P18031 6/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ STAT3 P40763 6/20 0.48
▸ POLB P06746 1/20 0.48
▸ CTDSP1 Q9GZU7 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
SCHEMBL31179891 0.91 ELANE (0.59) ELANEMAPTL3MBTL1PTPN1MEN1
Scandoside SCHEMBL29682452 0.89 L3MBTL1 (0.61) ELANEMAPTL3MBTL1PTPN1MEN1
Scandoside SCHEMBL307654 0.89 L3MBTL1 (0.61) ELANEMAPTL3MBTL1PTPN1MEN1
Scandoside SCHEMBL29426072 0.89 L3MBTL1 (0.61) ELANEMAPTL3MBTL1PTPN1MEN1
SCHEMBL29425898 0.82 ELANE (0.65) ELANEMAPTL3MBTL1PTPN1MEN1
SCHEMBL29896779 0.82 ELANE (0.65) ELANEMAPTL3MBTL1PTPN1MEN1
SCHEMBL20572206 0.82 ELANE (0.65) ELANEMAPTL3MBTL1PTPN1MEN1
SCHEMBL29425927 0.82 ELANE (0.65) ELANEMAPTL3MBTL1PTPN1MEN1
SCHEMBL29425962 0.82 L3MBTL1 (0.53) ELANEMAPTL3MBTL1PTPN1MEN1
Asperulosidic Acid SCHEMBL29459346 0.80 MAPT (0.52) ELANEMAPTL3MBTL1PTPN1MEN1

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
Send feedback