SCHEMBL16473402

SCHEMBL16473402

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

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TK1 P04183 2/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
ALB P02768 1/20 0.37
POLB P06746 1/20 0.37
ADRA1A P35348 1/20 0.37
BLM P54132 1/20 0.37
TYMP P19971 5/20 0.36
TK2 O00142 2/20 0.35
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL16473373 0.88 TK1 (0.38) TK1ALDH1A1LMNAALBPOLB
SCHEMBL16473410 0.88 TK1 (0.38) TK1ALDH1A1LMNAALBPOLB
SCHEMBL16473405 0.85 TK1 (0.40) TK1ALDH1A1LMNAALBPOLB
SCHEMBL16473356 0.85 TK1 (0.40) TK1ALDH1A1LMNAALBPOLB
SCHEMBL16473381 0.81 LMNA (0.44) TK1ALDH1A1LMNAALBPOLB
SCHEMBL16473421 0.81 LMNA (0.44) TK1ALDH1A1LMNAALBPOLB
SCHEMBL16473393 0.74 TK1 (0.43) TK1ALDH1A1LMNAALBPOLB
SCHEMBL13615532 0.73 ALDH1A1 (0.45) TK1ALDH1A1LMNAALBPOLB
SCHEMBL14565243 0.71 TK2 (0.55) TK1ALDH1A1LMNAALBPOLB
SCHEMBL18513323 0.70 TK2 (0.49) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9029335-B2 Substituted 2′-thio-bicyclic nucleosides and oligomeric compounds prepared therefrom ISIS PHARMACEUTICALS, INC. (US) 2015-05-12 US disclosed
US-20140106451-A1 SUBSTITUTED 2'-THIO-BICYCLIC NUCLEOSIDES AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM IONIS PHARMACEUTICALS, INC. 2014-04-17 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-20140106451-A1 SUBSTITUTED 2'-THIO-BICYCLIC NUCLEOSIDES AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM RNMT, HNRNPM, NSUN2 TK1 426/4885ALDH1A1 3079/4885LMNA 1796/4885

“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.