SCHEMBL21754783

SCHEMBL21754783

CC1C[C@H](OC(=O)c2ccccc2)[C@@H](COC(=O)c2ccccc2)O1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
UPP1 Q16831 1/20 0.51
ALDH1A1 P00352 1/20 0.47
NPC1 O15118 1/20 0.45
POLB P06746 2/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
PPM1B O75688 1/20 0.44
RNASE1 P07998 1/20 0.43
CHRNB2 P17787 1/20 0.43
CHRNA5 P30532 1/20 0.43
CHRNA7 P36544 1/20 0.43
CHRNA4 P43681 1/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
KMT2A Q03164 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
SCHEMBL12352421 1.00 UPP1 (0.51) UPP1ALDH1A1NPC1POLBGAA
SCHEMBL25838221 1.00 UPP1 (0.51) UPP1ALDH1A1NPC1POLBGAA
SCHEMBL14208919 1.00 UPP1 (0.51) UPP1ALDH1A1NPC1POLBGAA
SCHEMBL13871565 1.00 UPP1 (0.51) UPP1ALDH1A1NPC1POLBGAA
SCHEMBL12111820 0.90 UPP1 (0.46) UPP1ALDH1A1NPC1POLBGAA
SCHEMBL21637038 0.88 UPP1 (0.53) UPP1ALDH1A1NPC1GAARNASE1
SCHEMBL6973225 0.88 UPP1 (0.53) UPP1ALDH1A1NPC1GAARNASE1
SCHEMBL21913196 0.88 UPP1 (0.53) UPP1ALDH1A1NPC1GAARNASE1
SCHEMBL19412748 0.88 UPP1 (0.53) UPP1ALDH1A1NPC1GAARNASE1
SCHEMBL10260315 0.87 UPP1 (0.67) UPP1ALDH1A1POLBGAANPSR1

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-10570112-B2 Synthetic intermediate of 1-(2-deoxy-2-fluoro-4-thio-β-D-arabinofuranosyl)cytosine, synthetic intermediate of thionucleoside, and method for producing the same FUJIFILM CORPORATION (JP) 2020-02-25 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-10570112-B2 Synthetic intermediate of 1-(2-deoxy-2-fluoro-4-thio-β-D-arabinofuranosyl)cytosine, synthetic intermediate of thionucleoside, and method for producing the same TYMS, TYMP, RRM2B UPP1 201/4885ALDH1A1 679/4885NPC1 2262/4885

“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.