SCHEMBL3317307

SCHEMBL3317307

O=C(Nc1ncnc2c1ncn2C1OC(/C=C(\F)P(=O)(O)O)C(O)C1O)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 Q9H244 2/20 0.52
▸ P2RY2 P41231 1/20 0.49
▸ P2RY1 P47900 1/20 0.49
▸ P2RY6 Q15077 1/20 0.49
▸ DNPH1 O43598 2/20 0.49
▸ ADORA2A P29274 3/20 0.48
▸ ADORA2B P29275 3/20 0.48
▸ AHCY P23526 2/20 0.48
▸ BMPR1B O00238 1/20 0.47

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
SCHEMBL13396506 1.00 P2RY12 (0.52) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL3317321 1.00 P2RY12 (0.52) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL3320845 0.88 P2RY12 (0.51) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL3320850 0.88 P2RY12 (0.51) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL13396509 0.88 P2RY12 (0.51) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL3320860 0.86 P2RY12 (0.50) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL3314438 0.86 P2RY12 (0.53) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL3314461 0.86 P2RY12 (0.53) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL3314380 0.86 P2RY12 (0.53) P2RY12P2RY2P2RY1P2RY6DNPH1
SCHEMBL3316378 0.80 AHCY (0.73) P2RY2P2RY1DNPH1ADORA2AADORA2B

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 P2RY12 782/4885P2RY2 1511/4885P2RY1 505/4885

“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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