SCHEMBL2311319

SCHEMBL2311319

CC1(C)OC2OC(CO)(C(O[SiH](c3ccccc3)c3ccccc3)C(C)(C)C)C(OCc3ccccc3)C2O1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.31
▸ GSTP1 P09211 2/20 0.31
▸ IDO1 P14902 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
SCHEMBL2720695 0.79 KMT2A (0.37) MEN1KMT2AALDH1A1GSTP1IDO1
SCHEMBL16648568 0.79 — —
SCHEMBL26601015 0.76 MEN1 (0.34) MEN1KMT2AALDH1A1
SCHEMBL25967806 0.75 KMT2A (0.38) MEN1KMT2AALDH1A1GSTP1IDO1
SCHEMBL17356766 0.75 KMT2A (0.38) MEN1KMT2AALDH1A1GSTP1IDO1
SCHEMBL25967804 0.74 MEN1 (0.35) MEN1KMT2AALDH1A1GSTP1IDO1
SCHEMBL1059333 0.73 KMT2A (0.37) MEN1KMT2AALDH1A1IDO1
SCHEMBL20484797 0.73 KMT2A (0.37) MEN1KMT2AALDH1A1IDO1
SCHEMBL21085574 0.73 KMT2A (0.37) MEN1KMT2AALDH1A1IDO1
SCHEMBL25911629 0.73 KMT2A (0.37) MEN1KMT2AALDH1A1IDO1

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-8513214-B2 C4′-substituted-2-deoxyadenosine analogs and methods of treating HIV THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPT. OF HEALTH AND HUMAN SERVICES (US) 2013-08-20 — — US disclosed
US-20110190226-A1 C4'-SUBSTITUTED-2-DEOXYADENOSINE ANALOGS AND METHODS OF TREATING HIV THE GOV. OF THE U.S.A. AS REPRESENTED BY THE SECRETARY OF THE DEPT. OF HEALTH AND HUMAN SERVICES 2011-08-04 — — 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-20110190226-A1 C4'-SUBSTITUTED-2-DEOXYADENOSINE ANALOGS AND METHODS OF TREATING HIV ADORA3, ADA, ADAR MEN1 3671/4885KMT2A 1886/4885ALDH1A1 1687/4885

“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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