SCHEMBL22796830

SCHEMBL22796830

O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cc(F)c3ccccc3c2=S)C(O)C1O

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 20/20 0.64
P2RY4 P51582 5/20 0.62
P2RY6 Q15077 1/20 0.54

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
SCHEMBL6794723 0.90 P2RY2 (0.79) P2RY2P2RY4
SCHEMBL6795883 0.84 P2RY2 (0.81) P2RY2P2RY4
SCHEMBL6797765 0.80 P2RY2 (0.82) P2RY2P2RY4
SCHEMBL6794725 0.79 P2RY2 (0.63) P2RY2P2RY4P2RY6
SCHEMBL6797588 0.78 P2RY2 (0.79) P2RY2P2RY4
SCHEMBL6798776 0.78 P2RY2 (1.00) P2RY2P2RY4
SCHEMBL148675 0.78 P2RY6 (0.73) P2RY2P2RY4P2RY6
SCHEMBL148676 0.78 P2RY6 (0.73) P2RY2P2RY4P2RY6
SCHEMBL22796829 0.77 SLC5A2 (0.47) P2RY2
SCHEMBL6798887 0.77 P2RY2 (1.00) P2RY2P2RY4

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-20200392550-A1 REAGENTS AND METHODS FOR REPLICATION, TRANSCRIPTION, AND TRANSLATION IN SEMI-SYNTHETIC ORGANISMS THE SCRIPPS RESEARCH INSTITUTE 2020-12-17 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-20200392550-A1 REAGENTS AND METHODS FOR REPLICATION, TRANSCRIPTION, AND TRANSLATION IN SEMI-SYNTHETIC ORGANISMS RNGTT, MAX, POLRMT P2RY2 4798/4885P2RY4 4712/4885P2RY6 4365/4885

“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.