SCHEMBL25912271

SCHEMBL25912271

CC(C)[C@H](N)C(=O)Nc1ncnn2c([C@]3(C)O[C@H](COC(=O)Cc4ccccc4)[C@@H](O)[C@H]3O)ccc12

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.36
▸ IARS1 P41252 2/20 0.35
▸ MARS1 P56192 2/20 0.33
▸ LARS1 Q9P2J5 1/20 0.32
▸ GLS O94925 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
SCHEMBL25912290 0.90 TMPRSS2 (0.39) TMPRSS2IARS1
SCHEMBL25912244 0.89 TMPRSS2 (0.40) TMPRSS2IARS1MARS1LARS1
SCHEMBL24789427 0.89 TMPRSS2 (0.50) TMPRSS2IARS1MARS1LARS1
SCHEMBL30472930 0.89 TMPRSS2 (0.50) TMPRSS2IARS1MARS1LARS1
SCHEMBL25917380 0.89 TMPRSS2 (0.50) TMPRSS2IARS1MARS1LARS1
SCHEMBL24917187 0.89 TMPRSS2 (0.39) TMPRSS2IARS1
SCHEMBL25912296 0.89 TMPRSS2 (0.39) TMPRSS2IARS1MARS1
SCHEMBL24917640 0.88 TMPRSS2 (0.32) TMPRSS2IARS1
SCHEMBL25925135 0.87 TMPRSS2 (0.34) TMPRSS2IARS1MARS1
SCHEMBL24789732 0.87 TMPRSS2 (0.45) 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 100/4885IARS1 1159/4885MARS1 969/4885
US-20230233593-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS SLC29A2, SLC29A1, PNP TMPRSS2 100/4885IARS1 1159/4885MARS1 969/4885

“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.

Send feedback