SCHEMBL13848182

SCHEMBL13848182

O=C(O[C@H]1[C@@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)OC(O)C1(F)F)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LGALS9 O00182 1/20 0.37
▸ LGALS1 P09382 1/20 0.37
▸ LGALS3 P17931 1/20 0.37
▸ LGALS7; LGALS7B P47929 1/20 0.37
▸ TYMP P19971 12/20 0.36
▸ MAPK1 P28482 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ NT5E P21589 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ GAA P10253 1/20 0.32

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
SCHEMBL10017428 1.00 LGALS9 (0.37) LGALS9LGALS1LGALS3LGALS7; LGALS7BTYMP
SCHEMBL15849784 1.00 LGALS9 (0.37) LGALS9LGALS1LGALS3LGALS7; LGALS7BTYMP
SCHEMBL2786937 1.00 LGALS9 (0.37) LGALS9LGALS1LGALS3LGALS7; LGALS7BTYMP
SCHEMBL2786934 1.00 LGALS9 (0.37) LGALS9LGALS1LGALS3LGALS7; LGALS7BTYMP
SCHEMBL2786939 1.00 LGALS9 (0.37) LGALS9LGALS1LGALS3LGALS7; LGALS7BTYMP
SCHEMBL2787153 0.88 LGALS9 (0.34) LGALS9LGALS1LGALS3LGALS7; LGALS7BTYMP
SCHEMBL15849800 0.88 ALDH1A1 (0.35) LGALS9LGALS1LGALS3LGALS7; LGALS7BTYMP
SCHEMBL10017427 0.88 ALDH1A1 (0.35) LGALS9LGALS1LGALS3LGALS7; LGALS7BTYMP
SCHEMBL2787154 0.88 LGALS9 (0.34) LGALS9LGALS1LGALS3LGALS7; LGALS7BTYMP
SCHEMBL10017419 0.88 LGALS9 (0.34) LGALS9LGALS1LGALS3LGALS7; LGALS7BTYMP

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-20090124797-A1 NOVEL SYNTHESIS OF BETA-NUCLEOSIDES PHARMAESSENTIA CORPORATION (TW) 2009-05-14 — — 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-20090124797-A1 NOVEL SYNTHESIS OF BETA-NUCLEOSIDES DUT, DCTD, UMPS LGALS9 2596/4885LGALS1 4006/4885LGALS3 4431/4885

“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.

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