SCHEMBL17106714

SCHEMBL17106714

C#C[C@@]1([CH2])OC(c2ccc3c(N)ncnn23)CC1O

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.35
▸ DOT1L Q8TEK3 3/20 0.33
▸ STING1 Q86WV6 1/20 0.30
▸ MAP4K4 O95819 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
SCHEMBL17106845 0.83 POLRMT (0.37) POLRMTDOT1L
SCHEMBL17130417 0.83 POLRMT (0.37) POLRMTDOT1L
Phosphoric Acid SCHEMBL17106863 0.80 POLRMT (0.40) POLRMTDOT1L
SCHEMBL24941676 0.78 POLRMT (0.36) POLRMTDOT1L
SCHEMBL19412426 0.78 POLRMT (0.34) POLRMTDOT1L
SCHEMBL26270281 0.77 POLRMT (0.38) POLRMTDOT1LMAP4K4
SCHEMBL19412761 0.77 POLRMT (0.38) POLRMTDOT1LMAP4K4
SCHEMBL25401925 0.77 POLRMT (0.37) POLRMTDOT1L
SCHEMBL17114380 0.76 POLRMT (0.36) POLRMTDOT1LMAP4K4
SCHEMBL19412679 0.76 POLRMT (0.35) POLRMTDOT1L

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-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 (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-20150274767-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS DUT, HPRT1, RNGTT POLRMT 7/4885DOT1L 799/4885STING1 1542/4885

“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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