SCHEMBL25912366

SCHEMBL25912366

CC(C)[C@H](N)C(=O)O[C@H]1[C@@H](O)[C@](C)(c2ccc3c(NC(=O)[C@@H](N)Cc4ccc(F)cc4)ncnn23)O[C@@H]1CO

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.36
▸ MC3R P41968 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
SCHEMBL25912587 0.94 TMPRSS2 (0.37) TMPRSS2MC3R
SCHEMBL24917086 0.92 TMPRSS2 (0.38) TMPRSS2MC3R
SCHEMBL25912617 0.90 TMPRSS2 (0.36) TMPRSS2MC3R
SCHEMBL24791266 0.90 TMPRSS2 (0.37) TMPRSS2MC3R
SCHEMBL25316069 0.89 TMPRSS2 (0.47) TMPRSS2
SCHEMBL24917201 0.89 TMPRSS2 (0.47) TMPRSS2
SCHEMBL24791236 0.89 TMPRSS2 (0.40) TMPRSS2
SCHEMBL25912470 0.88 TMPRSS2 (0.35) TMPRSS2MC3R
SCHEMBL25912112 0.88 TMPRSS2 (0.35) TMPRSS2MC3R
SCHEMBL25912053 0.87 TMPRSS2 (0.45) TMPRSS2MC3R

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 100/4885MC3R 3923/4885
US-20230233593-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS SLC29A2, SLC29A1, PNP TMPRSS2 100/4885MC3R 3923/4885

“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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