SCHEMBL17131290

SCHEMBL17131290

C[C@H]1C[C@H](n2ccc3c(N)ncnc32)O[C@@H]1C=O

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 1/20 0.43
▸ PRMT5 O14744 15/20 0.43
▸ WDR77 Q9BQA1 12/20 0.43
▸ RAPGEF3 O95398 1/20 0.42
▸ METTL3 Q86U44 4/20 0.41

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
SCHEMBL23469016 1.00 ADK (0.43) ADKPRMT5WDR77RAPGEF3METTL3
SCHEMBL19412712 0.86 PRMT5 (0.49) ADKPRMT5WDR77RAPGEF3METTL3
SCHEMBL17131338 0.82 AHCY (0.34) —
SCHEMBL17131313 0.82 NT5E (0.37) PRMT5WDR77
SCHEMBL17106685 0.81 PRMT5 (0.40) ADKPRMT5WDR77RAPGEF3METTL3
SCHEMBL17131288 0.80 ADK (0.49) ADKPRMT5WDR77RAPGEF3METTL3
SCHEMBL17131289 0.79 ADK (0.51) ADKPRMT5WDR77RAPGEF3METTL3
SCHEMBL17131301 0.78 ADK (0.51) ADKPRMT5METTL3
SCHEMBL17131316 0.77 ADK (0.52) ADKPRMT5RAPGEF3METTL3
SCHEMBL17131296 0.77 PRMT5 (0.39) ADKPRMT5WDR77METTL3

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-20180002366-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-01-04 — — US disclosed
US-9777035-B2 4′-substituted nucleoside reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. (US) 2017-10-03 — — US disclosed
US-20150274767-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-10-01 — — 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-20180002366-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS DUT, HPRT1, RNGTT ADK 731/4885PRMT5 151/4885WDR77 744/4885
US-20150274767-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS DUT, HPRT1, RNGTT ADK 731/4885PRMT5 151/4885WDR77 744/4885

“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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