SCHEMBL10053491

SCHEMBL10053491

CC1C[C@H](n2cc(C#CCNC(=O)CCSSc3ccccn3)c(N)nc2=O)O[C@@H]1COP(=O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ POLG P54098 2/20 0.38
▸ P2RY2 P41231 5/20 0.36
▸ P2RY4 P51582 2/20 0.36
▸ P2RY6 Q15077 3/20 0.36
▸ GPR17 Q13304 2/20 0.35
▸ P2RY11 Q96G91 1/20 0.34
▸ P2RX3 P56373 1/20 0.34
▸ P2RX4 Q99571 1/20 0.34
▸ P2RX2 Q9UBL9 1/20 0.34

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
SCHEMBL10022231 0.94 P2RY2 (0.40) POLGP2RY2P2RY4P2RY6
SCHEMBL10020460 0.94 P2RY2 (0.40) POLGP2RY2P2RY4P2RY6
SCHEMBL13654806 0.83 CA2 (0.41) P2RY2P2RY11P2RX3P2RX4P2RX2
SCHEMBL22415081 0.83 CA2 (0.41) P2RY2P2RY11P2RX3P2RX4P2RX2
SCHEMBL10022250 0.83 CA2 (0.41) P2RY2P2RY11P2RX3P2RX4P2RX2
SCHEMBL17833854 0.82 POLG (0.43) POLGP2RY2P2RY4P2RY6
SCHEMBL12729532 0.82 POLG (0.43) POLGP2RY2P2RY4P2RY6
SCHEMBL10053469 0.81 P2RX3 (0.40) P2RY2P2RY11P2RX3P2RX4P2RX2
SCHEMBL13901157 0.80 DNMT1 (0.34) —
SCHEMBL13224522 0.80 P2RY2 (0.39) POLGP2RY2P2RY4P2RY6

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-8114973-B2 Nucleotide analogs HELICOS BIOSCIENCES CORPORATION (US) 2012-02-14 — — US disclosed
US-20090186351-A1 NUCLEOTIDE ANALOGS HELICOS BIOSCIENCES CORPORATION (US) 2009-07-23 — — 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-20090186351-A1 NUCLEOTIDE ANALOGS NT5C3B, RNGTT, NT5C2 POLG 166/4885P2RY2 289/4885P2RY4 148/4885

“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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