SCHEMBL10053469

SCHEMBL10053469

CC1C[C@H](n2cc(CNC(=O)CCSSc3ccccn3)c3c(N)ncnc32)O[C@@H]1COP(=O)(O)OP(=O)(O)OP(=O)(O)O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 8/20 0.40
▸ P2RX4 Q99571 7/20 0.40
▸ P2RX7 Q99572 3/20 0.40
▸ P2RY12 Q9H244 2/20 0.39
▸ P2RY2 P41231 1/20 0.39
▸ P2RY1 P47900 1/20 0.39
▸ P2RX2 Q9UBL9 4/20 0.38
▸ P2RX1 P51575 5/20 0.37
▸ DTYMK P23919 2/20 0.36
▸ ENPP1 P22413 1/20 0.36
▸ P2RX6 O15547 1/20 0.36
▸ P2RX5 Q93086 1/20 0.36
▸ P2RY11 Q96G91 1/20 0.36
▸ TRPM2 O94759 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ ATG7 O95352 1/20 0.35
▸ CHAT P28329 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
SCHEMBL10051753 0.93 POLB (0.43) P2RX3P2RX4P2RX7P2RY12P2RY2
SCHEMBL22415081 0.84 CA2 (0.41) P2RX3P2RX4P2RX7P2RY12P2RY2
SCHEMBL13654806 0.84 CA2 (0.41) P2RX3P2RX4P2RX7P2RY12P2RY2
SCHEMBL10022250 0.84 CA2 (0.41) P2RX3P2RX4P2RX7P2RY12P2RY2
SCHEMBL10053491 0.81 POLG (0.38) P2RX3P2RX4P2RY2P2RX2P2RY11
SCHEMBL13670363 0.80 P2RX3 (0.36) P2RX3P2RX4P2RX7P2RY12P2RY2
SCHEMBL10020460 0.75 P2RY2 (0.40) P2RY2TRPM2POLB
SCHEMBL10022231 0.75 P2RY2 (0.40) P2RY2TRPM2POLB
SCHEMBL24412667 0.75 P2RX3 (0.48) P2RX3P2RX4P2RX7P2RY2P2RY1
SCHEMBL10052113 0.74 POLB (0.39) P2RX3P2RY1P2RX2P2RX1DTYMK

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 P2RX3 260/4885P2RX4 291/4885P2RX7 347/4885

“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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