SCHEMBL18966050

SCHEMBL18966050

CO[C@@H]1OC(CO)[C@@H](O[C@@H]2OC(CO)[C@H](O[C@H]3OC(CO)[C@H](O)C(O[C@@H]4OC(CO)[C@H](O)C(O[C@@H]5OC(CO)[C@H](O)C(O)C5O)C4NC(C)=O)C3O)C(O)C2O)C(O)C1O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 7/20 0.58
▸ LGALS8 O00214 3/20 0.58
▸ LGALS4 P56470 1/20 0.58
▸ LGALS1 P09382 2/20 0.51
▸ LGALS7; LGALS7B P47929 2/20 0.51
▸ CD69 Q07108 1/20 0.50
▸ LGALS9 O00182 2/20 0.49
▸ CHIA Q9BZP6 1/20 0.47
▸ FGF1 P05230 1/20 0.47
▸ FGF2 P09038 1/20 0.47
▸ VEGFA P15692 1/20 0.47
▸ HPSE Q9Y251 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ MAPK1 P28482 2/20 0.46

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
SCHEMBL17945670 1.00 LGALS3 (0.58) LGALS3LGALS8LGALS4LGALS1LGALS7; LGALS7B
SCHEMBL21134603 1.00 LGALS3 (0.58) LGALS3LGALS8LGALS4LGALS1LGALS7; LGALS7B
SCHEMBL17955020 1.00 LGALS3 (0.58) LGALS3LGALS8LGALS4LGALS1LGALS7; LGALS7B
SCHEMBL17950825 1.00 LGALS3 (0.58) LGALS3LGALS8LGALS4LGALS1LGALS7; LGALS7B
SCHEMBL7717434 0.97 LGALS3 (0.62) LGALS3LGALS8LGALS4LGALS1LGALS7; LGALS7B
SCHEMBL7717439 0.97 LGALS3 (0.62) LGALS3LGALS8LGALS4LGALS1LGALS7; LGALS7B
SCHEMBL18649615 0.93 LGALS3 (0.52) LGALS3LGALS8LGALS4LGALS1LGALS7; LGALS7B
SCHEMBL18645639 0.93 LGALS3 (0.52) LGALS3LGALS8LGALS4LGALS1LGALS7; LGALS7B
SCHEMBL16407357 0.92 LGALS3 (0.64) LGALS3LGALS8LGALS4LGALS1LGALS7; LGALS7B
SCHEMBL23613765 0.92 LGALS3 (0.64) LGALS3LGALS8LGALS4LGALS1LGALS7; LGALS7B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3789766-A1 NOVEL GLYCAN CONJUGATES AND METHODS OF USE THEREOF Academia Sinica (TW) 2021-03-10 — — EP disclosed
EP-3248005-B1 NOVEL GLYCAN CONJUGATES AND METHODS OF USE THEREOF ACADEMIA SINICA (TW) 2020-12-09 — — EP disclosed
US-20200200758-A1 CANCER MARKERS AND METHODS OF USE THEREOF ACADEMIA SINICA (TW) 2020-06-25 — — US disclosed
WO-2017100796-A1 MODULATION OF GLOBOSERIES GLYCOSPHINGOLIPID SYNTHESIS AND CANCER BIOMARKERS SINACA, Academia (TW) 2017-06-15 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200200758-A1 CANCER MARKERS AND METHODS OF USE THEREOF B3GAT3, ST6GAL1, B4GALT1 LGALS3 32/4885LGALS8 76/4885LGALS4 40/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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