SCHEMBL25012574

SCHEMBL25012574

COC(C)(C)COC(=O)[C@H](C)NP(=O)(Oc1c(F)c(F)c(F)c(F)c1F)Oc1cccc2ccccc12

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.37
▸ BTN3A1 O00481 8/20 0.35
▸ ALDH1A1 P00352 3/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ OGG1 O15527 1/20 0.33
▸ NR2E1 Q9Y466 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ PTGS1 P23219 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HPGD P15428 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
SCHEMBL30269882 1.00 HTT (0.37) HTTBTN3A1ALDH1A1KDM4EHSD17B10
SCHEMBL13469494 0.92 HTT (0.39) HTTBTN3A1ALDH1A1KDM4EHSD17B10
SCHEMBL30472855 0.92 HTT (0.39) HTTBTN3A1ALDH1A1KDM4EHSD17B10
SCHEMBL23044633 0.87 MEN1 (0.39) HTTBTN3A1ALDH1A1KDM4EHSD17B10
SCHEMBL28986476 0.86 BTN3A1 (0.41) HTTBTN3A1ALDH1A1KDM4EOGG1
SCHEMBL29895522 0.86 BTN3A1 (0.41) HTTBTN3A1ALDH1A1KDM4EOGG1
SCHEMBL29637567 0.85 BTN3A1 (0.38) HTTBTN3A1ALDH1A1HSD17B10OGG1
SCHEMBL25013420 0.85 BTN3A1 (0.44) BTN3A1ALDH1A1KMT2AMEN1
SCHEMBL22065060 0.84 BTN3A1 (0.42) BTN3A1ALDH1A1KDM4EKMT2AMEN1
SCHEMBL20833545 0.84 BTN3A1 (0.42) BTN3A1ALDH1A1KDM4EKMT2AMEN1

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 HTT 3194/4885BTN3A1 3427/4885ALDH1A1 1269/4885

“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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