SCHEMBL13522449

SCHEMBL13522449

CC1(O)[C@@H](O)[C@@H](COP(=O)(O)OP(=O)(O)O)O[C@H]1n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.59
P2RY2 P41231 2/20 0.59
P2RY4 P51582 2/20 0.59
POLB P06746 1/20 0.57
FUT5 Q11128 1/20 0.55
NT5E P21589 1/20 0.54
KRAS P01116 3/20 0.54
P2RY6 Q15077 2/20 0.52
PNP P00491 1/20 0.51
POLG P54098 1/20 0.51
DCPS Q96C86 1/20 0.50
ENPP1 P22413 2/20 0.49
P2RY1 P47900 2/20 0.49
P2RY12 Q9H244 1/20 0.49
TAS1R3 Q7RTX0 1/20 0.48
TAS1R1 Q7RTX1 1/20 0.48
P2RX3 P56373 2/20 0.48
P2RX1 P51575 1/20 0.48
P2RY11 Q96G91 1/20 0.48
P2RX4 Q99571 1/20 0.48

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
SCHEMBL1576874 1.00 TGM2 (0.59) TGM2P2RY2P2RY4POLBFUT5
SCHEMBL10819892 1.00 TGM2 (0.59) TGM2P2RY2P2RY4POLBFUT5
Inx-09114 SCHEMBL10819844 0.99 P2RY2 (0.60) TGM2P2RY2P2RY4POLBFUT5
Inx-09114 SCHEMBL13522450 0.99 P2RY2 (0.60) TGM2P2RY2P2RY4POLBFUT5
Inx-09114 SCHEMBL14946248 0.99 P2RY2 (0.60) TGM2P2RY2P2RY4POLBFUT5
Inx-09114 SCHEMBL23319265 0.99 P2RY2 (0.60) TGM2P2RY2P2RY4POLBFUT5
Inx-09114 SCHEMBL14929056 0.99 P2RY2 (0.60) TGM2P2RY2P2RY4POLBFUT5
Inx-09114 SCHEMBL21006183 0.99 P2RY2 (0.60) TGM2P2RY2P2RY4POLBFUT5
Inx-09114 SCHEMBL21007234 0.99 P2RY2 (0.60) TGM2P2RY2P2RY4POLBFUT5
Inx-09114 SCHEMBL720114 0.99 P2RY2 (0.60) TGM2P2RY2P2RY4POLBFUT5

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-20100003217-A1 Compounds and Pharmaceutical Compositions for the Treatment of Viral Infections CRETTON-SCOTT ERIKA 2010-01-07 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-20100003217-A1 Compounds and Pharmaceutical Compositions for the Treatment of Viral Infections HAVCR2, PYGL, GOT1 TGM2 397/4885P2RY2 2250/4885P2RY4 1225/4885

“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.