SCHEMBL463206

SCHEMBL463206

Cc1c(CC(=O)O)c2ccsc2n1Cc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 14/20 0.74
PLA2G2A P14555 5/20 0.54
PLA2G1B P04054 1/20 0.54
ERCC1 P07992 1/20 0.52
ERCC5 P28715 1/20 0.52
FEN1 P39748 1/20 0.52
ERCC4 Q92889 1/20 0.52

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
SCHEMBL10074104 0.86 PTGDR2 (1.00) PTGDR2
SCHEMBL461272 0.82 PTGDR2 (0.53) PTGDR2PLA2G2APLA2G1BERCC1ERCC5
SCHEMBL398075 0.78 PTGDR2 (0.75) PTGDR2PLA2G2APLA2G1BERCC5FEN1
SCHEMBL2005075 0.75 PTGDR2 (0.62) PTGDR2PLA2G2APLA2G1B
SCHEMBL7963412 0.74 PLA2G2A (0.65) PTGDR2PLA2G2APLA2G1B
SCHEMBL400776 0.73 PTGDR2 (0.78) PTGDR2
SCHEMBL5437216 0.73 PLA2G2A (0.82) PTGDR2PLA2G2APLA2G1B
SCHEMBL1939991 0.73 PTGDR2 (1.00) PTGDR2
SCHEMBL2002870 0.73 PLA2G2A (0.82) PTGDR2PLA2G2APLA2G1B
SCHEMBL13802422 0.72 PTGDR2 (0.76) PTGDR2PLA2G2APLA2G1B

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 13/4885PLA2G2A 1870/4885PLA2G1B 1625/4885

“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.