SCHEMBL280492

SCHEMBL280492

C[C@@H]1[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O[C@@H](c2coc3c(N)ncnc23)[C@]1(C)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 7/20 0.46
P2RX4 Q99571 6/20 0.46
P2RX1 P51575 4/20 0.46
P2RX2 Q9UBL9 3/20 0.44
P2RX7 Q99572 1/20 0.43
ENTPD1 P49961 2/20 0.42
RNASEL Q05823 1/20 0.41
P2RY1 P47900 3/20 0.41
P2RY2 P41231 2/20 0.41
SRC P12931 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL264779 0.92 P2RX3 (0.47) P2RX3P2RX4P2RX1P2RX2ENTPD1
SCHEMBL264918 0.83 DNPH1 (0.42) P2RX3P2RX4P2RX1ENTPD1RNASEL
SCHEMBL264096 0.81 GPR17 (0.43) P2RX3P2RX4P2RX1P2RX2ENTPD1
SCHEMBL10182407 0.78 CA12 (0.41)
SCHEMBL12261199 0.72 P2RX1 (0.46) P2RX3P2RX4P2RX1P2RX2ENTPD1
SCHEMBL264091 0.72 ADORA2A (0.48) SMN1; SMN2
SCHEMBL13847085 0.72 ADORA2A (0.48) SMN1; SMN2
SCHEMBL4962425 0.72 ADORA2A (0.48) SMN1; SMN2
SCHEMBL14071995 0.72 P2RY1 (0.41) P2RX3P2RX4P2RX1P2RX2P2RY1
SCHEMBL264550 0.72 CA12 (0.33) ENTPD1

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-8133870-B2 Therapeutic furopyrimidines and thienopyrimidines BIOCRYST PHARMACEUTICALS, INC. (US) 2012-03-13 US disclosed
US-20080300200-A1 Therapeutic Furopyrimidines and Thienopyrimidines BIOCRYST PHARMACEUTICALS, INC. (US) 2008-12-04 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-20080300200-A1 Therapeutic Furopyrimidines and Thienopyrimidines DPYD, TYMP, TYMS P2RX3 1147/4885P2RX4 1188/4885P2RX1 1106/4885

“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.