SCHEMBL438227

SCHEMBL438227

CS(=O)(=O)c1c(CC(=O)O)c2ccsc2n1S(=O)(=O)c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 19/20 0.74
PTGDR Q13258 2/20 0.45
HTR6 P50406 1/20 0.41

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
SCHEMBL400709 0.81 PTGDR2 (1.00) PTGDR2
SCHEMBL397819 0.69 PTGDR2 (0.78) PTGDR2PTGDR
SCHEMBL10074104 0.68 PTGDR2 (1.00) PTGDR2
SCHEMBL463206 0.65 PTGDR2 (0.74) PTGDR2
SCHEMBL1941139 0.63 PTGDR2 (1.00) PTGDR2
SCHEMBL14560313 0.63 PTGDR2 (0.51) PTGDR2PTGDRHTR6
SCHEMBL6531329 0.62 PTGDR2 (1.00) PTGDR2PTGDR
SCHEMBL4091943 0.59 KDM4E (0.55) PTGDR2
SCHEMBL4103061 0.58 PTGS2 (0.49) PTGDR2
SCHEMBL30130273 0.57 KDM4E (0.59)

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-8101645-B2 Thienopyrroles and pyrrolothiazoles as new therapeutic agents ABBOTT LABORATORIES (US) 2012-01-24 US disclosed
US-20090209609-A1 Thienopyrroles and pyrrolothiazoles as new therapeutic agents ABBVIE INC. 2009-08-20 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-20090209609-A1 Thienopyrroles and pyrrolothiazoles as new therapeutic agents HRH2, HRH1, TSLP PTGDR2 13/4885PTGDR 30/4885HTR6 1502/4885

“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.