SCHEMBL5846892

SCHEMBL5846892

CC(=O)O[C@H]1O[C@@](COS(C)(=O)=O)(CS(C)(=O)=O)[C@@H](OCc2ccccc2)[C@H]1OC(C)=O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
GSTP1 P09211 2/20 0.34
LMNA P02545 1/20 0.33
BCHE P06276 2/20 0.33
CYP2D6 P10635 1/20 0.33
MAPK1 P28482 1/20 0.33
IDO1 P14902 1/20 0.32
METAP2 P50579 2/20 0.32
CAPN1 P07384 1/20 0.32
PRKCA P17252 1/20 0.32
SELP P16109 1/20 0.31

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
SCHEMBL5846888 1.00 ALDH1A1 (0.36) ALDH1A1GSTP1LMNABCHECYP2D6
SCHEMBL5696092 0.94 ALDH1A1 (0.39) ALDH1A1GSTP1LMNABCHECYP2D6
SCHEMBL5696091 0.94 ALDH1A1 (0.39) ALDH1A1GSTP1LMNABCHECYP2D6
SCHEMBL14511230 0.94 ALDH1A1 (0.39) ALDH1A1GSTP1LMNABCHECYP2D6
SCHEMBL14511226 0.92 ALDH1A1 (0.36) ALDH1A1GSTP1LMNABCHECYP2D6
SCHEMBL1098026 0.92 ALDH1A1 (0.36) ALDH1A1GSTP1LMNABCHECYP2D6
SCHEMBL1098024 0.92 ALDH1A1 (0.36) ALDH1A1GSTP1LMNABCHECYP2D6
SCHEMBL1096197 0.86 BCHE (0.39) ALDH1A1GSTP1BCHEMETAP2
SCHEMBL1097346 0.86 BCHE (0.39) ALDH1A1GSTP1BCHEMETAP2
SCHEMBL1096195 0.86 BCHE (0.39) ALDH1A1GSTP1BCHEMETAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1334109-B1 IMPROVED SYNTHESIS OF PURINE LOCKED NUCLEIC ACID ANALOGUES SANTARIS PHARMA AS (DK) 2006-05-10 EP disclosed
US-6998484-B2 Synthesis of purine locked nucleic acid analogues SANTARIS PHARMA A/S (DK) 2006-02-14 US disclosed
US-20020086998-A1 Synthesis of purine locked nucleic acid analogues SANTARIS PHARMA A/S (DK) 2002-07-04 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-20020086998-A1 Synthesis of purine locked nucleic acid analogues RNGTT, PNP, UNG ALDH1A1 1637/4885GSTP1 3174/4885LMNA 243/4885

“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.