SCHEMBL264096

SCHEMBL264096

CNc1ncnc2c([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@@]3(C)O)coc12

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR17 Q13304 2/20 0.43
P2RY2 P41231 3/20 0.43
P2RY4 P51582 1/20 0.43
P2RX3 P56373 5/20 0.42
P2RX2 Q9UBL9 4/20 0.42
P2RX4 Q99571 2/20 0.41
P2RY1 P47900 2/20 0.40
P2RX1 P51575 2/20 0.39
NT5E P21589 2/20 0.38
P2RY6 Q15077 1/20 0.38
P2RY12 Q9H244 1/20 0.38
ENTPD1 P49961 1/20 0.37

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
SCHEMBL264673 0.91 P2RY1 (0.35) P2RY2P2RY1P2RY12
SCHEMBL264779 0.89 P2RX3 (0.47) P2RY2P2RY4P2RX3P2RX2P2RX4
SCHEMBL2610998 0.84 P2RX3 (0.49) GPR17P2RY2P2RY4P2RX3P2RX2
SCHEMBL14071995 0.84 P2RY1 (0.41) GPR17P2RY2P2RX3P2RX2P2RX4
SCHEMBL280492 0.81 P2RX3 (0.46) P2RY2P2RX3P2RX2P2RX4P2RY1
SCHEMBL264655 0.79 ADORA3 (0.40)
SCHEMBL264918 0.79 DNPH1 (0.42) P2RY2P2RX3P2RX4P2RY1P2RX1
SCHEMBL13877182 0.79 P2RY2 (0.41) GPR17P2RY2P2RX3P2RX2P2RX4
SCHEMBL12253589 0.77 P2RY2 (0.44) GPR17P2RY2P2RY4P2RX3P2RX2
SCHEMBL14012413 0.75 ADORA3 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120213735-A1 THERAPEUTIC FUROPYRIMIDINES AND THIENOPYRIMIDINES BIOCRYST PHARMACEUTICALS, INC. (US) 2012-08-23 US disclosed
US-20120213735-A1 THERAPEUTIC FUROPYRIMIDINES AND THIENOPYRIMIDINES BIOCRYST PHARMACEUTICALS, INC. (US) 2012-08-23 US disclosed
US-8133870-B2 Therapeutic furopyrimidines and thienopyrimidines BIOCRYST PHARMACEUTICALS, INC. (US) 2012-03-13 US disclosed
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
US-20080300200-A1 Therapeutic Furopyrimidines and Thienopyrimidines BIOCRYST PHARMACEUTICALS, INC. (US) 2008-12-04 US disclosed
US-7429571-B2 Therapeutic furopyrimidines and thienopyrimidines BIOCRYST PHARMACEUTICALS, INC. (US) 2008-09-30 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 (2 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 GPR17 1585/4885P2RY2 1278/4885P2RY4 1086/4885
US-20120213735-A1 THERAPEUTIC FUROPYRIMIDINES AND THIENOPYRIMIDINES DPYD, TYMP, TYMS GPR17 1585/4885P2RY2 1278/4885P2RY4 1086/4885

“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.