SCHEMBL14827477

SCHEMBL14827477

[2H]CC1C=C[C@@H](n2cc(C)c(=O)[nH]c2=O)C[C@@H]1O

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TK1 P04183 4/20 0.49
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
ALB P02768 1/20 0.42
POLB P06746 1/20 0.42
ADRA1A P35348 1/20 0.42
BLM P54132 1/20 0.42

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
SCHEMBL8660778 0.81 TK1 (0.50) TK1ALDH1A1LMNAALBPOLB
SCHEMBL9149865 0.81 TK1 (0.50) TK1ALDH1A1LMNAALBPOLB
SCHEMBL14827483 0.77 ALDH1A1 (0.42) TK1ALDH1A1LMNAALBPOLB
SCHEMBL12416109 0.77 ALDH1A1 (0.42) TK1ALDH1A1LMNAALBPOLB
SCHEMBL8885542 0.74 ALDH1A1 (0.47) TK1ALDH1A1LMNAALBPOLB
SCHEMBL8885550 0.74 ALDH1A1 (0.47) TK1ALDH1A1LMNAALBPOLB
SCHEMBL17236359 0.73 TK1 (0.67) TK1POLB
SCHEMBL12718422 0.73 TK1 (0.67) TK1POLB
SCHEMBL8885421 0.72 TK1 (0.54) TK1ALDH1A1LMNAALBPOLB
SCHEMBL14827481 0.72 LMNA (0.51) TK1ALDH1A1LMNAALBPOLB

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-20130084576-A1 MODIFIED NUCLEOSIDES, ANALOGS THEREOF AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM ISIS PHARMACEUTICALS, INC. (US) 2013-04-04 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-20130084576-A1 MODIFIED NUCLEOSIDES, ANALOGS THEREOF AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM RNMT, HNRNPM, NOP2 TK1 525/4885ALDH1A1 4054/4885LMNA 545/4885

“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.