SCHEMBL25909966

SCHEMBL25909966

CCCCC(=O)Nc1ncnn2c([C@]3(C#N)O[C@H](CC)[C@@H](OC(=O)Cc4ccccc4)[C@H]3O)ccc12

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.44
▸ GSK3B P49841 1/20 0.32
▸ HTT P42858 1/20 0.31
▸ NCOA1 Q15788 1/20 0.31
▸ NCOA3 Q9Y6Q9 1/20 0.31
▸ BCHE P06276 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ EGLN2 Q96KS0 1/20 0.30
▸ TSHR P16473 1/20 0.30

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
SCHEMBL24791264 0.95 TMPRSS2 (0.48) TMPRSS2HTTNCOA1NCOA3BCHE
SCHEMBL25913894 0.95 TMPRSS2 (0.48) TMPRSS2HTTNCOA1NCOA3BCHE
SCHEMBL24789443 0.91 TMPRSS2 (0.49) TMPRSS2GSK3BALDH1A1EGLN2
SCHEMBL25909949 0.90 TMPRSS2 (0.43) TMPRSS2
SCHEMBL25909953 0.89 TMPRSS2 (0.54) TMPRSS2ALDH1A1EGLN2
SCHEMBL30091006 0.89 TMPRSS2 (0.39) TMPRSS2
SCHEMBL24917254 0.87 TMPRSS2 (0.49) TMPRSS2GSK3BHTTNCOA1NCOA3
SCHEMBL24791246 0.85 TMPRSS2 (0.47) TMPRSS2
SCHEMBL25912493 0.84 TMPRSS2 (0.49) TMPRSS2EGLN2
SCHEMBL25909961 0.84 TMPRSS2 (0.40) TMPRSS2

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-20230233593-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS VenatoRx Pharmaceuticals, Inc. 2023-07-27 — — US disclosed
US-11638715-B2 Orally-bioavailable nucleoside analogs VenatoRx Pharmaceuticals, Inc. (US) 2023-05-02 — — 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 (2 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-11638715-B2 Orally-bioavailable nucleoside analogs SLC29A2, SLC29A1, PNP TMPRSS2 100/4885GSK3B 3317/4885HTT 2401/4885
US-20230233593-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS SLC29A2, SLC29A1, PNP TMPRSS2 100/4885GSK3B 3317/4885HTT 2401/4885

“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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