SCHEMBL5908146

SCHEMBL5908146

C=CCOP(=O)(OCCC#N)O[C@H]1C[C@H](n2cnc3c(N)ncnc32)O[C@@H]1COC(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 2/20 0.45
▸ P2RX4 Q99571 2/20 0.45
▸ P2RX2 Q9UBL9 2/20 0.45
▸ P2RY12 Q9H244 1/20 0.43
▸ POLB P06746 1/20 0.42
▸ ENPP1 P22413 3/20 0.42
▸ P2RY1 P47900 1/20 0.42
▸ ABCB1 P08183 1/20 0.41
▸ P2RX6 O15547 1/20 0.41
▸ P2RX1 P51575 1/20 0.41
▸ P2RX5 Q93086 1/20 0.41
▸ P2RY11 Q96G91 1/20 0.41
▸ P2RX7 Q99572 1/20 0.41
▸ GSK3A P49840 1/20 0.40
▸ RPS6KA3 P51812 1/20 0.40
▸ MAPK14 Q16539 1/20 0.40

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
SCHEMBL5908147 0.90 CA5A (0.40) P2RX3P2RX4P2RX2P2RY1P2RY11
SCHEMBL5908150 0.90 NT5E (0.45) P2RY1P2RY11
SCHEMBL5694106 0.90 POLB (0.45) P2RY12POLBENPP1P2RY1P2RY11
SCHEMBL5694105 0.87 POLB (0.39) P2RX3P2RX4P2RX2POLBP2RY1
SCHEMBL5694039 0.86 P2RX3 (0.51) P2RX3P2RX4P2RX2P2RY12ENPP1
SCHEMBL5694075 0.84 POLB (0.41) POLB
SCHEMBL5694044 0.84 POLG (0.38) POLB
SCHEMBL17860588 0.82 ADORA1 (0.40) P2RY12POLBP2RY1
SCHEMBL5694100 0.81 NT5E (0.48) P2RY1P2RY11
SCHEMBL5694199 0.80 CA5A (0.42) P2RY1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060167241-A1 Method for synthesizing cyclic bisdinucleoside MITSUI CHEMICALS, INC. (JP) 2006-07-27 — — 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-20060167241-A1 Method for synthesizing cyclic bisdinucleoside NSUN2, POLR2H, POLB P2RX3 4092/4885P2RX4 4376/4885P2RX2 3908/4885

“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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