SCHEMBL17586590

SCHEMBL17586590

C[n+]1cn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C(O)[C@@H]2O)c2nc(N)[nH]c(=O)c21

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.57
FUT5 Q11128 1/20 0.55
P2RY2 P41231 8/20 0.55
P2RY6 Q15077 6/20 0.55
ENPP1 P22413 2/20 0.54
P2RY1 P47900 2/20 0.54
P2RX3 P56373 2/20 0.54
P2RX1 P51575 1/20 0.54
P2RY11 Q96G91 1/20 0.54
P2RX4 Q99571 1/20 0.54
KRAS P01116 2/20 0.54
P2RY12 Q9H244 1/20 0.53
P2RY4 P51582 4/20 0.52
NT5E P21589 1/20 0.52
DCPS Q96C86 1/20 0.52

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
SCHEMBL20597816 1.00 TGM2 (0.57) TGM2FUT5P2RY2P2RY6ENPP1
SCHEMBL21010336 0.99 TGM2 (0.57) TGM2FUT5P2RY2P2RY6ENPP1
SCHEMBL23754698 0.99 TGM2 (0.57) TGM2FUT5P2RY2P2RY6ENPP1
SCHEMBL18769111 0.97 TGM2 (0.59) TGM2FUT5P2RY2P2RY6P2RY1
SCHEMBL18769512 0.97 TGM2 (0.59) TGM2FUT5P2RY2P2RY6P2RY1
SCHEMBL18769341 0.97 TGM2 (0.59) TGM2FUT5P2RY2P2RY6P2RY1
SCHEMBL25433573 0.94 TGM2 (0.55) TGM2FUT5P2RY2P2RY6ENPP1
SCHEMBL19592001 0.94 P2RY2 (0.57) TGM2FUT5P2RY2P2RY6P2RX3
SCHEMBL2223109 0.93 TGM2 (0.57) TGM2FUT5P2RY2P2RY6P2RX3
SCHEMBL18769344 0.93 TGM2 (0.57) TGM2FUT5P2RY2P2RY6P2RX3

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-20160075733-A1 MODIFIED POLYNUCLEOTIDES FOR THE PRODUCTION OF BIOLOGICS AND PROTEINS ASSOCIATED WITH HUMAN DISEASE ARES CAPITAL CORPORATION, AS AGENT 2016-03-17 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-20160075733-A1 MODIFIED POLYNUCLEOTIDES FOR THE PRODUCTION OF BIOLOGICS AND PROTEINS ASSOCIATED WITH HUMAN DISEASE POLRMT, POLN, POLM TGM2 3805/4885FUT5 2012/4885P2RY2 2758/4885

“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.