SCHEMBL1058417

SCHEMBL1058417

COc1ccc(CC(=O)O)cc1-c1cc(NS(C)(=O)=O)ccc1CNC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
PTGDR2 Q9Y5Y4 9/20 0.44
CA5A P35218 1/20 0.43
EPHX2 P34913 1/20 0.42
FABP4 P15090 2/20 0.42
GAA P10253 1/20 0.42
TBXA2R P21731 1/20 0.40
PTGDR Q13258 1/20 0.40

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
SCHEMBL1060090 0.92 PTGDR2 (0.50) L3MBTL1PTGDR2CA5AFABP4GAA
SCHEMBL1059756 0.88 PTGDR2 (0.55) PTGDR2CA5AGAATBXA2RPTGDR
SCHEMBL3629305 0.86 PTGDR2 (0.49) PTGDR2CA5AGAATBXA2RPTGDR
SCHEMBL155869 0.83 PTGDR2 (0.54) PTGDR2TBXA2RPTGDR
SCHEMBL3622456 0.82 PTGDR2 (0.47) PTGDR2CA5AGAATBXA2RPTGDR
SCHEMBL1057069 0.80 PTGDR2 (0.59) PTGDR2CA5AGAATBXA2RPTGDR
SCHEMBL1059554 0.79 PTGDR2 (0.62) PTGDR2GAATBXA2RPTGDR
SCHEMBL140820 0.78 PTGDR2 (0.61) PTGDR2TBXA2RPTGDR
SCHEMBL1051736 0.78 PTGDR2 (0.56) PTGDR2GAATBXA2RPTGDR
SCHEMBL1059636 0.77 PTGDR2 (0.47) PTGDR2TBXA2RPTGDR

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-2245022-A2 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS Amira Pharmaceuticals, Inc. (US) 2010-11-03 EP claimed
WO-2009108720-A2 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2009-09-03 WO claimed
US-8497381-B2 Antagonists of prostaglandin D2 receptors PANMIRA PHARMACEUTICALS, LLC (US) 2013-07-30 US disclosed
US-20110021573-A1 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-01-27 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-20110021573-A1 ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 L3MBTL1 4353/4885PTGDR2 2/4885CA5A 2126/4885

“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.