SCHEMBL4273602

SCHEMBL4273602

CC(=O)OC[C@H]1O[C@H](n2cc(C)c(=O)[nH]c2=O)[C@](C)(F)[C@@]1(C)OC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.39
ALB P02768 1/20 0.39
POLB P06746 1/20 0.39
ADRA1A P35348 1/20 0.39
BLM P54132 1/20 0.39
TK1 P04183 5/20 0.38
ABCG2 Q9UNQ0 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ABCB1 P08183 1/20 0.36
TYMP P19971 1/20 0.36

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
SCHEMBL4263186 1.00 ALDH1A1 (0.39) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL4261514 1.00 ALDH1A1 (0.39) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL4269958 1.00 ALDH1A1 (0.39) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL4259801 1.00 ALDH1A1 (0.39) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL4275804 0.89 RNASE1 (0.45) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL4267257 0.89 RNASE1 (0.45) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL4261563 0.89 RNASE1 (0.45) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL4261262 0.89 RNASE1 (0.45) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL4268441 0.89 RNASE1 (0.45) ALDH1A1LMNAALBPOLBADRA1A
SCHEMBL4264583 0.84 ALDH1A1 (0.40) ALDH1A1LMNAALBPOLBADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8227431-B2 Nucleoside derivatives HETERO DRUGS LIMITED (IN) 2012-07-24 US claimed
WO-2009115893-A2 NOVEL NUCLEOSIDE DERIVATIVES HETERO RESEARCH FOUNDATION (IN) 2009-09-24 WO claimed
US-20090233879-A1 NOVEL NUCLEOSIDE DERIVATIVES HETERO DRUGS LIMITED (IN) 2009-09-17 US claimed
US-8227431-B2 Nucleoside derivatives HETERO DRUGS LIMITED (IN) 2012-07-24 US disclosed
WO-2009115893-A2 NOVEL NUCLEOSIDE DERIVATIVES HETERO RESEARCH FOUNDATION (IN) 2009-09-24 WO disclosed
US-20090233879-A1 NOVEL NUCLEOSIDE DERIVATIVES HETERO DRUGS LIMITED (IN) 2009-09-17 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 (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-20090233879-A1 NOVEL NUCLEOSIDE DERIVATIVES ENTPD5, PNP, ENTPD1 ALDH1A1 2855/4885LMNA 2060/4885ALB 4828/4885

“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.