SCHEMBL13614476

SCHEMBL13614476

NC(CCCP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(NC(=O)Nc3ccccc3)nc2=O)C(OC(=O)Oc2ccccc2)[C@H]1O)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 11/20 0.51
P2RY6 Q15077 14/20 0.47
P2RY12 Q9H244 3/20 0.47
P2RY14 Q15391 2/20 0.47
NT5E P21589 1/20 0.47
P2RY4 P51582 10/20 0.47

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
SCHEMBL13614855 1.00 P2RY2 (0.51) P2RY2P2RY6P2RY12P2RY14NT5E
SCHEMBL13614434 0.86 P2RY6 (0.56) P2RY2P2RY6P2RY12P2RY4
SCHEMBL14017190 0.86 P2RY6 (0.56) P2RY2P2RY6P2RY12P2RY4
SCHEMBL16326106 0.74 P2RY2 (0.31) P2RY2P2RY12
SCHEMBL13614457 0.73 P2RY2 (0.59) P2RY2P2RY6P2RY12P2RY14P2RY4
SCHEMBL14017231 0.73 P2RY2 (0.59) P2RY2P2RY6P2RY12P2RY14P2RY4
SCHEMBL13614856 0.73 P2RY6 (0.45) P2RY2P2RY6P2RY14NT5EP2RY4
SCHEMBL13614478 0.73 P2RY6 (0.45) P2RY2P2RY6P2RY14NT5EP2RY4
SCHEMBL24220783 0.72 P2RY6 (0.66) P2RY2P2RY6P2RY14NT5EP2RY4
SCHEMBL13614552 0.72 P2RY2 (0.68) P2RY2P2RY6P2RY4

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-7612047-B2 Degradation-resistant mononucleoside phosphate compounds INSPIRE PHARMACEUTICALS, INC. (US) 2009-11-03 US disclosed
US-20090076256-A1 DEGRADATION-RESISTANT MONONUCLEOSIDE PHOSPHATE COMPOUNDS DOUGLASS III JAMES G 2009-03-19 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-20090076256-A1 DEGRADATION-RESISTANT MONONUCLEOSIDE PHOSPHATE COMPOUNDS PNKP, ENTPD5, ENPP1 P2RY2 75/4885P2RY6 39/4885P2RY12 65/4885

“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.