SCHEMBL13614583

SCHEMBL13614583

CC(C)(C)P(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](N2C=C3C=C(c4ccc5ccccc5c4)OC3NC2=O)C2OC(C3CCCC3)O[C@H]21

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 12/20 0.34
P2RY2 P41231 10/20 0.34
P2RY6 Q15077 4/20 0.33
DNPH1 O43598 1/20 0.31
TRPM2 O94759 1/20 0.31
P2RY4 P51582 1/20 0.31
B4GALT1 P15291 1/20 0.31

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
SCHEMBL13614934 1.00 P2RY12 (0.34) P2RY12P2RY2P2RY6DNPH1TRPM2
SCHEMBL13614516 0.93 P2RY12 (0.35) P2RY12P2RY2P2RY6DNPH1P2RY4
SCHEMBL14017341 0.93 P2RY12 (0.35) P2RY12P2RY2P2RY6DNPH1P2RY4
SCHEMBL16349151 0.89 P2RY2 (0.31) P2RY2P2RY6
SCHEMBL14017300 0.80 P2RY2 (0.42) P2RY2P2RY6DNPH1TRPM2P2RY4
SCHEMBL13614498 0.80 P2RY2 (0.42) P2RY2P2RY6DNPH1TRPM2P2RY4
SCHEMBL13614550 0.74 P2RY2 (0.41) P2RY2P2RY6DNPH1P2RY4
SCHEMBL13614888 0.74 P2RY2 (0.41) P2RY2P2RY6DNPH1P2RY4
SCHEMBL16326152 0.74
SCHEMBL13614497 0.72 B4GALT1 (0.43) P2RY2P2RY6TRPM2P2RY4B4GALT1

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 P2RY12 65/4885P2RY2 75/4885P2RY6 39/4885

“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.