SCHEMBL24917394

SCHEMBL24917394

CN=C[C@@]1(c2ccc3c(NC(=O)c4ccccc4)ncnn23)O[C@H](COC(=O)CC2CCCCC2)[C@@H](O)[C@H]1O

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.31
▸ HTR2C P28335 1/20 0.30
▸ SLC6A4 P31645 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
SCHEMBL24789418 0.88 TMPRSS2 (0.35) TMPRSS2TDP1
SCHEMBL24917272 0.88 TMPRSS2 (0.43) TMPRSS2TDP1
SCHEMBL24789734 0.87 TMPRSS2 (0.42) TMPRSS2TDP1HTR2CSLC6A4
SCHEMBL24917269 0.86 TMPRSS2 (0.42) TMPRSS2
SCHEMBL25913466 0.84 TMPRSS2 (0.58) TMPRSS2TDP1
SCHEMBL24917107 0.84 TMPRSS2 (0.58) TMPRSS2TDP1
SCHEMBL24916883 0.83 POLRMT (0.33) TMPRSS2
SCHEMBL25919712 0.82 TMPRSS2 (0.45) TMPRSS2
SCHEMBL24917295 0.81 TMPRSS2 (0.35) TMPRSS2
SCHEMBL24917317 0.78 POLRMT (0.32) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230024722-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS VenatoRx Pharmaceuticals, Inc. 2023-01-26 — — 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-20230024722-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS SLC29A2, SLC29A1, PNP TMPRSS2 100/4885TDP1 874/4885HTR2C 1580/4885

“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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