SCHEMBL22404764

SCHEMBL22404764

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

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GBA1 P04062 5/20 0.54
▸ GJB2 P29033 4/20 0.54
▸ TNF P01375 1/20 0.51
▸ MAPK1 P28482 1/20 0.50
▸ LGALS8 O00214 1/20 0.49
▸ LGALS3 P17931 1/20 0.49
▸ LGALS4 P56470 1/20 0.49
▸ MGAM O43451 2/20 0.41
▸ SI P14410 2/20 0.41

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
SCHEMBL19681968 1.00 GBA1 (0.54) GBA1GJB2TNFMAPK1LGALS8
SCHEMBL19678133 1.00 GBA1 (0.54) GBA1GJB2TNFMAPK1LGALS8
SCHEMBL17857935 1.00 GBA1 (0.54) GBA1GJB2TNFMAPK1LGALS8
SCHEMBL19678120 1.00 GBA1 (0.54) GBA1GJB2TNFMAPK1LGALS8
SCHEMBL19682033 1.00 GBA1 (0.54) GBA1GJB2TNFMAPK1LGALS8
SCHEMBL19678117 1.00 GBA1 (0.54) GBA1GJB2TNFMAPK1LGALS8
SCHEMBL22390598 1.00 GBA1 (0.54) GBA1GJB2TNFMAPK1LGALS8
SCHEMBL22390606 1.00 GBA1 (0.54) GBA1GJB2TNFMAPK1LGALS8
SCHEMBL22390602 1.00 GBA1 (0.54) GBA1GJB2TNFMAPK1LGALS8
SCHEMBL19678132 1.00 GBA1 (0.54) GBA1GJB2TNFMAPK1LGALS8

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-20200281956-A1 ANTIBACTERIAL COMPOSITION CONTAINING A DEOXYHEXOSE ALKYL MONOACETAL OR MONOETHER CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2020-09-10 — — 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-20200281956-A1 ANTIBACTERIAL COMPOSITION CONTAINING A DEOXYHEXOSE ALKYL MONOACETAL OR MONOETHER DPM1, GNE, DERA GBA1 273/4885GJB2 3277/4885TNF 621/4885

“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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