SCHEMBL22604145

SCHEMBL22604145

CC1OC(CO)C(O)C(O)C1NC(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LGALS8 O00214 1/20 0.49
NAAA Q02083 2/20 0.46
HRAS P01112 1/20 0.46
HK1 P19367 2/20 0.45
HK2 P52789 2/20 0.45
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
CPB1 P15086 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
SCHEMBL9746872 0.88 HK1 (0.58) LGALS8HRASHK1HK2ALDH1A1
SCHEMBL18803484 0.88 HK1 (0.58) LGALS8HRASHK1HK2ALDH1A1
SCHEMBL12812847 0.88 HK1 (0.58) LGALS8HRASHK1HK2ALDH1A1
SCHEMBL10522400 0.88 HK1 (0.58) LGALS8HRASHK1HK2ALDH1A1
SCHEMBL7147563 0.88 HK1 (0.58) LGALS8HRASHK1HK2ALDH1A1
SCHEMBL10521162 0.88 HK1 (0.58) LGALS8HRASHK1HK2ALDH1A1
SCHEMBL15763312 0.88 HK1 (0.58) LGALS8HRASHK1HK2ALDH1A1
SCHEMBL14780667 0.88 HK1 (0.58) LGALS8HRASHK1HK2ALDH1A1
SCHEMBL374488 0.88 HK1 (0.58) LGALS8HRASHK1HK2ALDH1A1
SCHEMBL8537938 0.86 LGALS8 (0.61) LGALS8HRAS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11059842-B2 Monosaccharide amine and 3-nitro-2-phenyl-2H-chromene based inhibitors of glucose kinases UNIVERSITY OF SOUTH CAROLINA (US) 2021-07-13 US disclosed
US-20200339619-A1 Monosaccharide Amine and 3-Nitro-2-Phenyl-2H-Chromene Based Inhibitors of Glucose Kinases UNIVERSITY OF SOUTH CAROLINA 2020-10-29 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 (2 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-20200339619-A1 Monosaccharide Amine and 3-Nitro-2-Phenyl-2H-Chromene Based Inhibitors of Glucose Kinases GALK1, GCK, FN3K LGALS8 572/4885NAAA 863/4885HRAS 3958/4885
US-11059842-B2 Monosaccharide amine and 3-nitro-2-phenyl-2H-chromene based inhibitors of glucose kinases GALK1, GCK, FN3K LGALS8 572/4885NAAA 863/4885HRAS 3958/4885

“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.