SCHEMBL25915192

SCHEMBL25915192

N#C[C@@]1(c2ccc3c(NC4CCC(CC(=O)Cl)CC4)ncnn23)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.57
▸ IRAK4 Q9NWZ3 3/20 0.34
▸ ADORA3 P0DMS8 2/20 0.31
▸ ADORA2A P29274 1/20 0.31
▸ ADORA2B P29275 1/20 0.31
▸ ADORA1 P30542 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
SCHEMBL25216402 0.91 TMPRSS2 (0.62) TMPRSS2IRAK4ADORA3ADORA2AADORA2B
SCHEMBL23959988 0.80 TMPRSS2 (0.66) TMPRSS2
SCHEMBL24106482 0.79 TMPRSS2 (0.67) TMPRSS2ADORA3ADORA1
SCHEMBL25915257 0.79 TMPRSS2 (0.59) TMPRSS2ADORA3ADORA2AADORA1
SCHEMBL30973741 0.78 TMPRSS2 (0.66) TMPRSS2
SCHEMBL26004234 0.77 TMPRSS2 (0.62) TMPRSS2ADORA3ADORA2AADORA2BADORA1
SCHEMBL24789761 0.77 TMPRSS2 (0.67) TMPRSS2ADORA2AADORA1
SCHEMBL24791785 0.77 TMPRSS2 (0.79) TMPRSS2ADORA3ADORA1
SCHEMBL30960132 0.76 TMPRSS2 (0.71) TMPRSS2
SCHEMBL30973747 0.76 TMPRSS2 (0.66) 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 100/4885IRAK4 2821/4885ADORA3 291/4885
US-20230233593-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS SLC29A2, SLC29A1, PNP TMPRSS2 100/4885IRAK4 2821/4885ADORA3 291/4885

“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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