SCHEMBL25012742

SCHEMBL25012742

C[C@H](NP(=O)(OC[C@H]1O[C@@](C)(c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O)Oc1ccc(C(C)(C)C)cc1)C(=O)OCC1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DOT1L Q8TEK3 2/20 0.33
▸ CYP3A4 P08684 2/20 0.32
▸ CYP2C9 P11712 2/20 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
SCHEMBL24149115 0.98 DOT1L (0.33) DOT1LCYP3A4CYP2C9
SCHEMBL24148691 0.97 DOT1L (0.34) DOT1LCYP3A4CYP2C9
SCHEMBL25014033 0.93 DOT1L (0.33) DOT1LCYP3A4CYP2C9
SCHEMBL24149800 0.93 DOT1L (0.33) DOT1LCYP3A4CYP2C9
SCHEMBL24148771 0.92 CYP3A4 (0.34) DOT1LCYP3A4CYP2C9
SCHEMBL24148975 0.91 BTN3A1 (0.35) DOT1LCYP3A4CYP2C9
SCHEMBL24149199 0.91 DOT1L (0.33) DOT1LCYP3A4CYP2C9
SCHEMBL24148931 0.91 DOT1L (0.33) DOT1LCYP3A4CYP2C9
SCHEMBL25012732 0.91 CYP3A4 (0.38) CYP3A4CYP2C9
SCHEMBL24149679 0.90 DOT1L (0.33) DOT1LCYP3A4CYP2C9

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-20230040586-A1 1'-CYANO NUCLEOSIDE ANALOGS AND USES THEREOF GILEAD SCIENCES, INC. 2023-02-09 — — 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-20230040586-A1 1'-CYANO NUCLEOSIDE ANALOGS AND USES THEREOF TYMP, PNP, DUT DOT1L 3182/4885CYP3A4 1932/4885CYP2C9 2637/4885

“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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