SCHEMBL5847481

SCHEMBL5847481

Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 8/20 0.74
P2RX4 Q99571 7/20 0.74
P2RX2 Q9UBL9 5/20 0.74
P2RY1 P47900 4/20 0.70
P2RY2 P41231 4/20 0.70
P2RY12 Q9H244 3/20 0.70
P2RX1 P51575 5/20 0.68
P2RX7 Q99572 3/20 0.68
ENPP1 P22413 1/20 0.66
P2RX6 O15547 1/20 0.66
P2RX5 Q93086 1/20 0.66
P2RY11 Q96G91 1/20 0.66
RNASEL Q05823 1/20 0.66
SRC P12931 1/20 0.63
ALDH1A1 P00352 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63

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
SCHEMBL5848304 0.94 ENPP1 (0.73) P2RX3P2RX4P2RX2P2RY1P2RY2
SCHEMBL5847211 0.94 RNASEL (0.73) P2RX3P2RX4P2RX2P2RY1P2RY2
SCHEMBL22174968 0.86 P2RX3 (0.73) P2RX3P2RX4P2RX2P2RY1P2RY2
SCHEMBL19404164 0.86 P2RX3 (0.73) P2RX3P2RX4P2RX2P2RY1P2RY2
SCHEMBL26571082 0.85 P2RX3 (0.68) P2RX3P2RX4P2RX2P2RY1P2RY2
SCHEMBL5847412 0.85 P2RX3 (1.00) P2RX3P2RX4P2RX2P2RY1P2RY2
SCHEMBL27354771 0.85 RNASEL (0.77) P2RX3P2RX4P2RX2P2RY1P2RY2
SCHEMBL27354661 0.85 RNASEL (0.77) P2RX3P2RX4P2RX2P2RY1P2RY2
SCHEMBL14017388 0.84 P2RX3 (0.72) P2RX3P2RX4P2RX2P2RY1P2RY2
SCHEMBL13614604 0.84 P2RX3 (0.72) P2RX3P2RX4P2RX2P2RY1P2RY2

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7084128-B2 Method for reducing intraocular pressure INSPIRE PHARMACEUTICALS, INC. (US) 2006-08-01 US claimed
US-6881725-B2 Method for treating pain INSPIRE PHARMACEUTICALS INC. (US) 2005-04-19 US claimed
US-20030186928-A1 Method for reducing intraocular pressure INSPIRE PHARMACEUTICALS, INC. 2003-10-02 US claimed
EP-1348466-A2 Method for treating pain with adenosine-tetraphosphates Inspire Pharmaceuticals, Inc. (US) 2003-10-01 EP claimed
US-20030158147-A1 Method for treating pain INSPIRE PHARMACEUTICALS INC. 2003-08-21 US claimed
US-7084128-B2 Method for reducing intraocular pressure INSPIRE PHARMACEUTICALS, INC. (US) 2006-08-01 US disclosed
US-6881725-B2 Method for treating pain INSPIRE PHARMACEUTICALS INC. (US) 2005-04-19 US disclosed
US-20030186928-A1 Method for reducing intraocular pressure INSPIRE PHARMACEUTICALS, INC. 2003-10-02 US disclosed
EP-1348466-A2 Method for treating pain with adenosine-tetraphosphates Inspire Pharmaceuticals, Inc. (US) 2003-10-01 EP disclosed
US-20030158147-A1 Method for treating pain INSPIRE PHARMACEUTICALS INC. 2003-08-21 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 (2 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-20030158147-A1 Method for treating pain P2RX2, P2RX3, P2RX5 P2RX3 2/4885P2RX4 7/4885P2RX2 1/4885
US-20030186928-A1 Method for reducing intraocular pressure P2RY1, P2RY11, P2RY6 P2RX3 7/4885P2RX4 20/4885P2RX2 6/4885

“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.