SCHEMBL24917183

SCHEMBL24917183

CC(=O)OC[C@H]1O[C@@](C)(c2ccc3c(NC(=O)c4ccccc4)ncnn23)[C@H](O)[C@@H]1O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.47
▸ TRIP13 Q15645 1/20 0.34
▸ XDH P47989 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ ACACB O00763 1/20 0.32
▸ CYP3A4 P08684 1/20 0.31
▸ EGLN2 Q96KS0 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
SCHEMBL25912214 0.92 TMPRSS2 (0.46) TMPRSS2TDP1HTTALDH1A1NPC1
SCHEMBL25912228 0.92 TMPRSS2 (0.46) TMPRSS2TDP1HTTALDH1A1NPC1
SCHEMBL24789732 0.90 TMPRSS2 (0.45) TMPRSS2TDP1HTTALDH1A1NPC1
SCHEMBL25912237 0.90 TMPRSS2 (0.44) TMPRSS2TDP1HTTALDH1A1NPC1
SCHEMBL25912181 0.89 TMPRSS2 (0.46) TMPRSS2TDP1HTTACACB
SCHEMBL24789767 0.89 TMPRSS2 (0.58) TMPRSS2TDP1ALDH1A1NPC1ATM
SCHEMBL24789731 0.87 TMPRSS2 (0.64) TMPRSS2TRIP13XDHTDP1HTT
SCHEMBL24789734 0.87 TMPRSS2 (0.42) TMPRSS2TDP1ALDH1A1NPC1ATM
SCHEMBL25912209 0.86 TMPRSS2 (0.43) TMPRSS2TDP1HTT
SCHEMBL24917171 0.85 TMPRSS2 (0.39) TMPRSS2XDH

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 3 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
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 (3 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 100/4885TRIP13 3733/4885XDH 1228/4885
US-11638715-B2 Orally-bioavailable nucleoside analogs SLC29A2, SLC29A1, PNP TMPRSS2 100/4885TRIP13 3733/4885XDH 1228/4885
US-20230233593-A1 ORALLY-BIOAVAILABLE NUCLEOSIDE ANALOGS SLC29A2, SLC29A1, PNP TMPRSS2 100/4885TRIP13 3733/4885XDH 1228/4885

“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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