SCHEMBL31179934

SCHEMBL31179934

C[C@@H]1[C@H]2[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)OC=C(C(=O)O)[C@H]2C[C@H]1OC(=O)/C=C/c1ccc(O)c(O)c1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.61
▸ STAT3 P40763 8/20 0.52
▸ HSP90AA1 P07900 2/20 0.50
▸ CYP3A4 P08684 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ PRKCA P17252 3/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ KDM1A O60341 1/20 0.48
▸ BACE1 P56817 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.47
▸ GLA P06280 1/20 0.47
▸ ELANE P08246 1/20 0.46
▸ GAA P10253 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL29425873 0.92 MAPT (0.64) MAPTSTAT3HSP90AA1CYP3A4KDM4E
SCHEMBL421961 0.79 ELANE (0.58) MAPTSTAT3HSP90AA1CYP3A4ALDH1A1
SCHEMBL424577 0.79 ELANE (0.58) MAPTSTAT3HSP90AA1CYP3A4ALDH1A1
SCHEMBL29441825 0.79 MAPT (0.65) MAPTSTAT3
SCHEMBL29413889 0.79 MAPT (0.65) MAPTSTAT3
SCHEMBL29408805 0.79 MAPT (0.65) MAPTSTAT3
Loganic Acid SCHEMBL29426077 0.77 MAPT (1.00) MAPTSTAT3
Loganic Acid SCHEMBL31179995 0.77 MAPT (1.00) MAPTSTAT3
Loganic Acid SCHEMBL308008 0.77 MAPT (1.00) MAPTSTAT3
SCHEMBL29413891 0.76 MAPT (0.63) MAPTSTAT3

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