SCHEMBL3317816

SCHEMBL3317816

CO[C@@H]1[C@H](OC(=O)c2ccccc2)[C@@H](C=CP(=O)(O)O)O[C@H]1n1cnc2c(NC(=O)c3ccccc3)ncnc21

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 2/20 0.46
▸ P2RX4 Q99571 2/20 0.46
▸ P2RX2 Q9UBL9 2/20 0.46
▸ PRMT6 Q96LA8 1/20 0.45
▸ P2RY12 Q9H244 10/20 0.42
▸ ENPP1 P22413 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
▸ P2RY2 P41231 1/20 0.41
▸ P2RY1 P47900 1/20 0.41
▸ P2RY6 Q15077 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.40
▸ DNPH1 O43598 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
SCHEMBL3317779 1.00 P2RX3 (0.46) P2RX3P2RX4P2RX2PRMT6P2RY12
SCHEMBL3313835 0.90 PRMT6 (0.45) P2RX3P2RX4P2RX2PRMT6P2RY12
SCHEMBL3313840 0.90 PRMT6 (0.45) P2RX3P2RX4P2RX2PRMT6P2RY12
SCHEMBL3313829 0.90 PRMT6 (0.45) P2RX3P2RX4P2RX2PRMT6P2RY12
SCHEMBL3313825 0.90 PRMT6 (0.45) P2RX3P2RX4P2RX2PRMT6P2RY12
SCHEMBL13396901 0.85 PRMT6 (0.43) P2RX3P2RX4P2RX2PRMT6P2RY12
SCHEMBL14102309 0.85 PRMT6 (0.43) P2RX3P2RX4P2RX2PRMT6P2RY12
SCHEMBL19777693 0.83 PRMT6 (0.55) P2RX3P2RX4P2RX2PRMT6P2RY12
SCHEMBL19780104 0.83 PRMT6 (0.55) P2RX3P2RX4P2RX2PRMT6P2RY12
SCHEMBL13396559 0.83 PRMT6 (0.55) P2RX3P2RX4P2RX2PRMT6P2RY12

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-8324179-B2 Nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2012-12-04 — — US disclosed
US-20100104532-A1 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-04-29 — — US disclosed
WO-2008100447-A2 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2008-08-21 — — WO 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-20100104532-A1 NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT SLC29A1, NUDT1, EIF2AK2 P2RX3 2337/4885P2RX4 2016/4885P2RX2 2494/4885

“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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