SCHEMBL17131292

SCHEMBL17131292

CC[C@H]1O[C@@H](n2cc(F)c3c(N)ncnc32)C[C@@H]1C

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 8/20 0.45
▸ CA2 P00918 1/20 0.41
▸ PRMT5 O14744 10/20 0.40
▸ WDR77 Q9BQA1 6/20 0.40
▸ METTL3 Q86U44 3/20 0.39

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
SCHEMBL17131291 0.90 ADK (0.43) ADKCA2PRMT5WDR77METTL3
SCHEMBL17131299 0.87 ADK (0.52) ADKCA2PRMT5METTL3
SCHEMBL17131315 0.86 ADK (0.61) ADKPRMT5METTL3
SCHEMBL10015663 0.86 ADK (0.61) ADKPRMT5WDR77METTL3
SCHEMBL17131320 0.86 METTL3 (0.50) ADKPRMT5METTL3
SCHEMBL17131324 0.86 ADK (0.61) ADKPRMT5WDR77METTL3
SCHEMBL15576185 0.82 CA2 (0.44) ADKCA2PRMT5METTL3
SCHEMBL17131296 0.81 PRMT5 (0.39) ADKCA2PRMT5WDR77METTL3
SCHEMBL18490333 0.80 ADK (0.52) ADKCA2PRMT5METTL3
SCHEMBL17106858 0.80 ADK (0.52) ADKCA2PRMT5METTL3

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 731/4885CA2 4838/4885PRMT5 151/4885
US-20150274767-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS DUT, HPRT1, RNGTT ADK 731/4885CA2 4838/4885PRMT5 151/4885

“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.

Send feedback