SCHEMBL25625445

SCHEMBL25625445

CCCCCCO[C@@H]1OC(CO)[C@H](O)CC1O

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.52
▸ GJB2 P29033 4/20 0.45
▸ GBA1 P04062 2/20 0.41
▸ LGALS8 O00214 2/20 0.40
▸ LGALS3 P17931 2/20 0.40
▸ LGALS4 P56470 2/20 0.40
▸ TNF P01375 1/20 0.39
▸ CETP P11597 1/20 0.36
▸ GBA2 Q9HCG7 1/20 0.36

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
SCHEMBL4320956 1.00 MAPK1 (0.52) MAPK1GJB2GBA1LGALS8LGALS3
SCHEMBL23016754 0.86 LGALS8 (0.57) MAPK1GJB2GBA1LGALS8LGALS3
SCHEMBL19535635 0.85 MAPK1 (0.40) MAPK1GJB2CETP
SCHEMBL13708836 0.82 LGALS8 (0.64) MAPK1GJB2LGALS8LGALS3LGALS4
SCHEMBL29291459 0.82 MAPK1 (0.57) MAPK1GJB2GBA1LGALS8LGALS3
SCHEMBL1842874 0.81 LGALS8 (0.47) MAPK1GJB2GBA1LGALS8LGALS3
SCHEMBL3392883 0.81 LGALS8 (0.47) MAPK1GJB2GBA1LGALS8LGALS3
SCHEMBL19669024 0.81 GBA1 (0.43) MAPK1GJB2GBA1TNF
SCHEMBL18352198 0.81 GBA1 (0.43) MAPK1GJB2GBA1TNF
SCHEMBL20147800 0.80 TK1 (0.38) MAPK1

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-20230181607-A1 THIOSACCHARIDES FOR USE IN TREATING CORONAVIRUS INFECTION The University of the Regents of California (US) 2023-06-15 — — 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-20230181607-A1 THIOSACCHARIDES FOR USE IN TREATING CORONAVIRUS INFECTION TMPRSS4, ACE, ACE2 MAPK1 4868/4885GJB2 4068/4885GBA1 361/4885

“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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