SCHEMBL17539017

SCHEMBL17539017

CC(=O)OC1O[C@@H](CO)[C@@H](O)[C@H](OC(C)=O)[C@@H]1O

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LGALS8 O00214 8/20 0.57
▸ PTPN1 P18031 1/20 0.48
▸ CD69 Q07108 1/20 0.46
▸ LGALS9 O00182 2/20 0.41
▸ LGALS1 P09382 2/20 0.41
▸ LGALS3 P17931 2/20 0.41
▸ SLC28A3 Q9HAS3 3/20 0.40
▸ THRB P10828 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ LGALS7; LGALS7B P47929 1/20 0.40
▸ CYP2D6 P10635 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MAPK1 P28482 1/20 0.39

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
SCHEMBL16152123 0.91 LGALS8 (0.51) LGALS8PTPN1CD69SLC28A3THRB
SCHEMBL15250843 0.91 LGALS8 (0.51) LGALS8PTPN1CD69SLC28A3THRB
SCHEMBL16340826 0.91 LGALS8 (0.51) LGALS8PTPN1CD69SLC28A3THRB
SCHEMBL13496092 0.91 LGALS8 (0.51) LGALS8PTPN1CD69SLC28A3THRB
SCHEMBL16342089 0.91 LGALS8 (0.51) LGALS8PTPN1CD69SLC28A3THRB
SCHEMBL29220914 0.90 LGALS8 (0.71) LGALS8PTPN1CD69LGALS9LGALS3
SCHEMBL7539269 0.90 LGALS8 (0.50) LGALS8PTPN1CD69LGALS9SLC28A3
SCHEMBL15985656 0.90 LGALS8 (0.50) LGALS8PTPN1CD69LGALS9SLC28A3
SCHEMBL7535550 0.90 LGALS8 (0.50) LGALS8PTPN1CD69LGALS9SLC28A3
SCHEMBL7539275 0.90 LGALS8 (0.50) LGALS8PTPN1CD69LGALS9SLC28A3

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-20160038615-A1 SACCHARIDE CONJUGATES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-02-11 — — 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-20160038615-A1 SACCHARIDE CONJUGATES BLM, DCLRE1A, MAN1B1 LGALS8 132/4885PTPN1 3913/4885CD69 2305/4885

“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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