SCHEMBL24916840

SCHEMBL24916840

N#C[C@]1(c2ccc3c(NC(=O)CCc4ccc(F)cc4)ncnn23)CC[C@@H](COC(=O)Cc2ccccc2)O1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 3/20 0.33
▸ TMPRSS2 O15393 1/20 0.33
▸ KMT2A Q03164 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ ALPL P05186 1/20 0.31
▸ ALPI P09923 1/20 0.31
▸ ALPG P10696 1/20 0.31
▸ EGLN2 Q96KS0 1/20 0.30
▸ YAP1 P46937 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
SCHEMBL24916835 0.89 TMPRSS2 (0.32) TMPRSS2EGLN2
SCHEMBL24916826 0.87 TMPRSS2 (0.40) TMPRSS2KMT2AKDM4EALDH1A1
SCHEMBL25912110 0.86 TMPRSS2 (0.34) TMPRSS2
SCHEMBL25912156 0.84 TMPRSS2 (0.32) TMPRSS2
SCHEMBL25912077 0.82 TMPRSS2 (0.33) MGLLTMPRSS2
SCHEMBL24916929 0.81 TMPRSS2 (0.33) MGLLTMPRSS2
SCHEMBL25608337 0.81 MGLL (0.38) MGLLTMPRSS2EGLN2
SCHEMBL25914014 0.77 TMPRSS2 (0.34) TMPRSS2
SCHEMBL25913461 0.76 TMPRSS2 (0.34) TMPRSS2ALDH1A1
SCHEMBL25914220 0.74 TMPRSS2 (0.33) 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-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 (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-20230024722-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS SLC29A2, SLC29A1, PNP MGLL 1174/4885TMPRSS2 100/4885KMT2A 3232/4885
US-20230233593-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS SLC29A2, SLC29A1, PNP MGLL 1174/4885TMPRSS2 100/4885KMT2A 3232/4885

“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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