SCHEMBL1195231

SCHEMBL1195231

Cc1nn(CCc2ccccc2)c(C)c1CC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 18/20 0.62
GAA P10253 1/20 0.59
LPAR1 Q92633 1/20 0.51

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
SCHEMBL509015 0.85 PTGDR2 (0.81) PTGDR2GAA
SCHEMBL1194896 0.79 PTGDR2 (0.51) PTGDR2
SCHEMBL11250573 0.77 PTGDR2 (0.50) PTGDR2
SCHEMBL508501 0.77 PTGDR2 (1.00) PTGDR2GAA
SCHEMBL10142366 0.76 PTGDR2 (1.00) PTGDR2
SCHEMBL8514171 0.75 PTGDR2 (0.62) PTGDR2GAA
SCHEMBL11975895 0.75 SLC22A12 (0.65)
SCHEMBL10143205 0.75 PTGDR2 (1.00) PTGDR2GAA
SCHEMBL508276 0.75 PTGDR2 (1.00) PTGDR2GAA
SCHEMBL10142865 0.75 PTGDR2 (1.00) PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2155685-B1 PYRAZOLE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LTD (GB) 2011-03-16 EP disclosed
US-20110046137-A1 Pyrazole Derivatives as P2X7 Modulators GLAXO GROUP LIMITED 2011-02-24 US disclosed
EP-2155685-A1 PYRAZOLE DERIVATIVES AS P2X7 MODULATORS Glaxo Group Limited (GB) 2010-02-24 EP disclosed
WO-2008138876-A1 PYRAZOLE DERIVATIVES AS P2X7 MODULATORS GLAXO GROUP LIMITED (GB) 2008-11-20 WO 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-20110046137-A1 Pyrazole Derivatives as P2X7 Modulators P2RX3, P2RX7, P2RX1 PTGDR2 486/4885GAA 2832/4885LPAR1 877/4885

“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.