SCHEMBL20154817

SCHEMBL20154817

OC[C@H]1O[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)[C@@H](O)[C@@H]1O

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TYMP P19971 12/20 0.48
SLC5A2 P31639 3/20 0.44

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
SCHEMBL10408396 0.94 TYMP (0.52) TYMP
SCHEMBL5438423 0.94 TYMP (0.52) TYMP
SCHEMBL5443832 0.94 TYMP (0.52) TYMP
SCHEMBL23113802 0.89 TYMP (0.49) TYMP
SCHEMBL3194078 0.89 TYMP (0.49) TYMP
SCHEMBL3194070 0.89 TYMP (0.49) TYMP
SCHEMBL20502250 0.89 PTPN1 (0.49) TYMPSLC5A2
SCHEMBL23525559 0.89 KIF11 (0.42) TYMPSLC5A2
SCHEMBL8158741 0.88 TYMP (0.48) TYMPSLC5A2
SCHEMBL22033901 0.88 TYMP (0.48) TYMPSLC5A2

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-10441564-B2 Fructose analogs and their combinations as anti-cancer agents Jia, Wei (US) 2019-10-15 US disclosed
US-20180133192-A1 Fructose analogs and their combinations as anti-cancer agents JIA, WEI 2018-05-17 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-20180133192-A1 Fructose analogs and their combinations as anti-cancer agents ALDOA, FBP1, MPI TYMP 1573/4885SLC5A2 10/4885
US-10441564-B2 Fructose analogs and their combinations as anti-cancer agents ALDOA, FBP1, MPI TYMP 1434/4885SLC5A2 10/4885

“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.