SCHEMBL23959872

SCHEMBL23959872

N#Cc1cc([C@]2(C#N)O[C@H](CO)[C@@H](O)[C@H]2O)n2ncnc(N)c12

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.47
▸ PIK3CD O00329 9/20 0.39
▸ ACVRL1 P37023 2/20 0.36
▸ CDK5 Q00535 1/20 0.35
▸ CDK5R1 Q15078 1/20 0.35
▸ RIPK1 Q13546 1/20 0.35

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
SCHEMBL23959861 0.87 TMPRSS2 (0.47) TMPRSS2PIK3CDACVRL1
SCHEMBL23959882 0.87 TMPRSS2 (0.47) TMPRSS2PIK3CDACVRL1CDK5CDK5R1
SCHEMBL25826835 0.87 TMPRSS2 (0.47) TMPRSS2PIK3CDACVRL1CDK5CDK5R1
SCHEMBL23959862 0.87 TMPRSS2 (0.47) TMPRSS2ACVRL1
SCHEMBL23960096 0.87 TMPRSS2 (0.47) TMPRSS2PIK3CDACVRL1CDK5CDK5R1
SCHEMBL23959859 0.87 TMPRSS2 (0.47) TMPRSS2PIK3CDACVRL1CDK5CDK5R1
SCHEMBL23959873 0.85 TMPRSS2 (0.51) TMPRSS2PIK3CDACVRL1CDK5CDK5R1
Gs-441524 SCHEMBL24667691 0.82 TMPRSS2 (0.60) TMPRSS2ACVRL1CDK5CDK5R1
Gs-441524 SCHEMBL24975226 0.82 TMPRSS2 (0.60) TMPRSS2ACVRL1CDK5CDK5R1
Gs-441524 SCHEMBL23870459 0.82 TMPRSS2 (0.60) TMPRSS2ACVRL1CDK5CDK5R1

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-20230219993-A1 ANTIVIRAL APPLICATION OF NUCLEOSIDE ANALOG OR COMBINATION FORMULATION CONTAINING NUCLEOSIDE ANALOG VIGONVITA LIFE SCIENCES CO., LTD. (CN) 2023-07-13 — — US disclosed
US-20230219993-A1 ANTIVIRAL APPLICATION OF NUCLEOSIDE ANALOG OR COMBINATION FORMULATION CONTAINING NUCLEOSIDE ANALOG VIGONVITA LIFE SCIENCES CO., LTD. (CN) 2023-07-13 — — US disclosed
WO-2021213288-A1 ANTIVIRAL APPLICATION OF NUCLEOSIDE ANALOG OR COMBINATION FORMULATION CONTAINING NUCLEOSIDE ANALOG 中国科学院上海药物研究所 (CN) 2021-10-28 — — WO 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 (1 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-20230219993-A1 ANTIVIRAL APPLICATION OF NUCLEOSIDE ANALOG OR COMBINATION FORMULATION CONTAINING NUCLEOSIDE ANALOG PNP, TYMP, PIGS TMPRSS2 145/4885PIK3CD 774/4885ACVRL1 712/4885

“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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