SCHEMBL1468928

SCHEMBL1468928

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

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TK1 P04183 3/20 0.48
LMNA P02545 3/20 0.48
ALB P02768 2/20 0.48
BLM P54132 2/20 0.48
ALDH1A1 P00352 1/20 0.48
POLB P06746 1/20 0.48
ADRA1A P35348 1/20 0.48
TK2 O00142 1/20 0.47
TSHR P16473 2/20 0.47
PKM P14618 1/20 0.47
PMP22 Q01453 1/20 0.47
CYP2D6 P10635 1/20 0.47

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
SCHEMBL12747393 1.00 TK1 (0.48) TK1LMNAALBBLMALDH1A1
SCHEMBL769371 1.00 TK1 (0.48) TK1LMNAALBBLMALDH1A1
SCHEMBL2695014 0.91 TK1 (0.46) TK1LMNAALBBLMALDH1A1
SCHEMBL5930446 0.90 LMNA (0.52) TK1LMNAALBBLMALDH1A1
SCHEMBL22819195 0.90 LMNA (0.52) TK1LMNAALBBLMALDH1A1
SCHEMBL5930585 0.90 LMNA (0.52) TK1LMNAALBBLMALDH1A1
SCHEMBL1471401 0.89 LMNA (0.51) TK1LMNAALBBLMALDH1A1
SCHEMBL1471399 0.89 LMNA (0.51) TK1LMNAALBBLMALDH1A1
SCHEMBL14827484 0.88 TK1 (0.48) TK1LMNAALBBLMALDH1A1
SCHEMBL1468885 0.87 PYGM (0.56) TK1LMNAADRA1ATK2

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-20110070192-A1 Method of preparation of novel nucleoside analogs and uses AUSPEX PHARMACEUTICALS, INC. 2011-03-24 US disclosed
WO-2005049582-A1 METHOD OF PREPARATION OF NOVEL NUCLEOSIDE ANALOGS AND USES AUSPEX PHARMACEUTICALS, INC. (US) 2005-06-02 WO 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-20110070192-A1 Method of preparation of novel nucleoside analogs and uses RNGTT, TYMP, SLC29A1 TK1 17/4885LMNA 493/4885ALB 3889/4885

“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.