SCHEMBL18104016

SCHEMBL18104016

CO[C@@H]1C(CO)OC[C@@H](O)C1O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SPHK1 Q9NYA1 1/20 0.34
▸ MGAM O43451 4/20 0.33
▸ GAA P10253 3/20 0.33
▸ LGALS8 O00214 2/20 0.33
▸ LGALS3 P17931 1/20 0.33
▸ AMY2A P04746 1/20 0.32
▸ OGA O60502 1/20 0.32
▸ SI P14410 2/20 0.31
▸ PYGB P11216 1/20 0.31

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
SCHEMBL19721647 1.00 SPHK1 (0.34) SPHK1MGAMGAALGALS8LGALS3
SCHEMBL19276934 1.00 SPHK1 (0.34) SPHK1MGAMGAALGALS8LGALS3
SCHEMBL21233490 1.00 SPHK1 (0.34) SPHK1MGAMGAALGALS8LGALS3
SCHEMBL13467759 0.88 SPHK1 (0.36) SPHK1MGAMGAALGALS8LGALS3
SCHEMBL19297652 0.88 SPHK1 (0.36) SPHK1MGAMGAALGALS8LGALS3
SCHEMBL25995092 0.86 SPHK1 (0.35) SPHK1MGAMGAALGALS8LGALS3
SCHEMBL23057091 0.85 AMY2A (0.51) LGALS8LGALS3AMY2A
SCHEMBL21251555 0.85 AMY2A (0.51) LGALS8LGALS3AMY2A
SCHEMBL26469994 0.85 AMY2A (0.51) LGALS8LGALS3AMY2A
SCHEMBL22423210 0.85 LGALS3 (0.37) SPHK1MGAMGAALGALS8LGALS3

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-20160279224-A1 PROTEIN AND PEPTIDE-FREE SYNTHETIC VACCINES AGAINST STREPTOCOCCUS PNEUMONIAE TYPE 3 MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2016-09-29 — — 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-20160279224-A1 PROTEIN AND PEPTIDE-FREE SYNTHETIC VACCINES AGAINST STREPTOCOCCUS PNEUMONIAE TYPE 3 STT3A, DDOST, LGALS3BP SPHK1 970/4885MGAM 172/4885GAA 1640/4885

“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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