SCHEMBL17880710

SCHEMBL17880710

COc1ccc(O[C@@H]2OC(CO)[C@@H](O)[C@H](C)C2OC(=O)c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 3/20 0.52
▸ LGALS9 O00182 2/20 0.52
▸ LGALS1 P09382 2/20 0.52
▸ LGALS7; LGALS7B P47929 2/20 0.52
▸ LGALS8 O00214 3/20 0.50
▸ MAOB P27338 1/20 0.45
▸ SLC5A1 P13866 1/20 0.45
▸ SLC5A2 P31639 1/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ LGALS4 P56470 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43

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
SCHEMBL17880706 0.92 PTPN1 (0.45) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL23121472 0.89 LGALS9 (0.51) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL17773535 0.86 LGALS3 (0.60) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL15475562 0.85 LGALS3 (0.50) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL15483275 0.85 LGALS3 (0.50) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL15475566 0.85 LGALS3 (0.50) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL15481391 0.85 LGALS3 (0.50) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL14127611 0.81 LGALS3 (0.58) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL21045068 0.81 PTPN1 (0.49) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8
SCHEMBL29220895 0.81 LGALS3 (0.47) LGALS3LGALS9LGALS1LGALS7; LGALS7BLGALS8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160185881-A1 Oligosaccharide Compounds CALLAGHAN INNOVATION RESEARCH LIMITED (NZ) 2016-06-30 — — US 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-20160185881-A1 Oligosaccharide Compounds BACE1, BACE2, ENGASE LGALS3 241/4885LGALS9 236/4885LGALS1 152/4885

“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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