SCHEMBL25916120

SCHEMBL25916120

N#C[C@]1(c2ccc3c(N)ncnn23)C[C@H](O)C[C@@H](COC(=O)Cc2ccccc2)O1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 2/20 0.36
▸ TMPRSS2 O15393 1/20 0.31
▸ RIPK1 Q13546 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TNK2 Q07912 1/20 0.31
▸ DOT1L Q8TEK3 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
SCHEMBL25916628 0.89 TMPRSS2 (0.32) TMPRSS2RIPK1
SCHEMBL25608337 0.88 MGLL (0.38) MGLLTMPRSS2RIPK1TNK2
SCHEMBL25916466 0.85 TMPRSS2 (0.32) TMPRSS2RIPK1
SCHEMBL30090990 0.81 MGLL (0.35) MGLLTMPRSS2RIPK1KMT2A
SCHEMBL25916095 0.80 RIPK1 (0.30) RIPK1
SCHEMBL24312592 0.79 TMPRSS2 (0.46) MGLLTMPRSS2RIPK1
SCHEMBL24917025 0.79 RIPK1 (0.34) MGLLTMPRSS2RIPK1TNK2DOT1L
SCHEMBL25608469 0.79 MGLL (0.39) MGLLRIPK1TNK2
SCHEMBL24790995 0.77 TMPRSS2 (0.40) MGLLTMPRSS2RIPK1KMT2A
SCHEMBL25607729 0.77 TMPRSS2 (0.40) MGLLTMPRSS2RIPK1DOT1L

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 MGLL 1174/4885TMPRSS2 100/4885RIPK1 2571/4885
US-20230233593-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS SLC29A2, SLC29A1, PNP MGLL 1174/4885TMPRSS2 100/4885RIPK1 2571/4885

“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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