SCHEMBL6512561

SCHEMBL6512561

Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)C2OCF)c(=O)[nH]c1=O

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TK2 O00142 2/20 0.64
TYMP P19971 4/20 0.53
PYGM P11217 3/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
ALB P02768 1/20 0.52
POLB P06746 1/20 0.52
ADRA1A P35348 1/20 0.52
BLM P54132 1/20 0.52

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
SCHEMBL5414718 1.00 TK2 (0.64) TK2TYMPPYGMALDH1A1LMNA
SCHEMBL12718467 0.93 TK2 (0.65) TK2TYMPPYGMALDH1A1LMNA
SCHEMBL12748371 0.93 TK2 (0.65) TK2TYMPPYGMALDH1A1LMNA
SCHEMBL12718222 0.93 TK2 (0.65) TK2TYMPPYGMALDH1A1LMNA
SCHEMBL12749200 0.93 TK2 (0.65) TK2TYMPPYGMALDH1A1LMNA
SCHEMBL24229243 0.91 TK2 (0.67) TK2TYMPPYGMALDH1A1LMNA
SCHEMBL5502489 0.91 TK2 (0.67) TK2TYMPPYGMALDH1A1LMNA
SCHEMBL5502493 0.91 TK2 (0.67) TK2TYMPPYGMALDH1A1LMNA
SCHEMBL10267691 0.91 TK2 (0.67) TK2TYMPPYGMALDH1A1LMNA
SCHEMBL12718535 0.90 TK2 (0.69) TK2TYMPPYGMALDH1A1LMNA

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-20050266422-A1 Fluoroalkoxy, nucleosides, nucleotides, and polynucleotides SIRNA THERAPEUTICS, INC. (US) 2005-12-01 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-20050266422-A1 Fluoroalkoxy, nucleosides, nucleotides, and polynucleotides NSUN3, IRF3, SNRPF TK2 944/4885TYMP 598/4885PYGM 4725/4885

“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.